C_ID |
CAS ID |
Metabolite |
Molecular formula |
Mw | Organism or InChIKey etc. |
C00000001 | 545-97-1 | Gibberellin A1 | C19H24O6 | 348.1572885 | Glycine max |
C00000008 | 7044-72-6 | Gibberellin A8 | C19H24O7 | 364.15220312 | Glycine max |
C00000019 | 6980-44-5 | Gibberellin A19 | C20H26O6 | 362.17293856 | Glycine max |
C00000020 | 19143-87-4 | Gibberellin A20 | C19H24O5 | 332.16237388 | Glycine max |
C00000053 | 51576-08-0 | Gibberellin A53 | C20H28O5 | 348.193674 | Glycine max |
C00000091 | 1637-39-4 | trans-Zeatin | C10H13N5O | 219.11201007 | Glycine max |
C00000096 | 6025-53-2 | 9-Ribosyl-trans-zeatin | C15H21N5O5 | 351.15426882 | Glycine max |
C00000117 | 2456-73-7 | Indole-3-acetyl-L-aspartic acid | C14H14N2O5 | 290.09027157 | Glycine max. |
C00000152 | 7400-08-0 | p-Coumaric acid | C9H8O3 | 164.04734412 | Glycine max |
C00000170 | 140-10-3 | Cinnamate | C9H8O2 | 148.0524295 | Glycine max |
C00000206 | 69-72-7 | Salicylic acid | C7H6O3 | 138.03169406 | Glycine max |
C00000207 | 65-85-0 | Benzoic acid | C7H6O2 | 122.03677944 | Glycine max |
C00000208 | 59-67-6 | Vitamin B3 | C6H5NO2 | 123.03202841 | Glycine max |
C00000218 | 6894-38-8 | Jasmonic acid | C12H18O3 | 210.12559444 | Glycine max |
C00000256 | 595-15-3 | Soyasapogenol B | C30H50O3 | 458.37599546 | Glycine max |
C00000364 | 67597-26-6 | 13(S)-Hydroperoxylinolenic acid | C18H30O4 | 310.21440945 | Glycine max |
C00000365 | 85551-10-6 | 12-Oxophytodienoic acid | C18H28O3 | 292.20384476 | Glycine max |
C00000446 | 62653-85-4 | (+)-Epijasmonic acid | C12H18O3 | 210.12559444 | Glycine max |
C00000615 | 501-16-6 | Caffeic acid | C9H8O4 | 180.04225874 | Glycine max |
C00000733 | 617-12-9 | Chorismate | C10H10O6 | 226.04773805 | Glycine max |
C00000734 | 22642-82-6 | Isochorismic acid | C10H10O6 | 226.04773805 | Glycine max |
C00000848 | 358-71-4 | Isopentenyl diphosphate | C5H12O7P2 | 246.00582572 | Glycine max |
C00000908 | 6699-20-3 | Geranylgeranyl diphosphate | C20H36O7P2 | 450.19362648 | Glycine max |
C00000919 | 7235-40-7 | E-beta-carotene | C40H56 | 536.43820179 | Glycine max |
C00000920 | 472-70-8 | beta-Cryptoxanthin | C40H56O | 552.43311641 | Glycine max |
C00000977 | 578-86-9 | Liquiritigenin | C15H12O4 | 256.07355887 | Glycine max |
C00000982 | 480-41-1 | Naringenin | C15H12O5 | 272.06847349 | Glycine max |
C00001110 | 3681-93-4 | Vitexin | C21H20O10 | 432.10564686 | Glycine max |
C00001150 | 470-55-3 | Stachyose | C24H42O21 | 666.22185841 | Glycine max |
C00001151 | 57-50-1 | Sucrose | C12H22O11 | 342.11621155 | Glycine max |
C00001158 | 106777-19-9 | 2-Carboxyarabinitol 1-phosphate | C6H13O10P | 276.02463313 | Glycine max |
C00001179 | 50-81-7 | (+)-Ascorbic acid | C6H8O6 | 176.03208799 | Glycine max |
C00001203 | 138-59-0 | Shikimic acid | C7H10O5 | 174.05282343 | Glycine max |
C00001224 | 60-33-3 | Linoleic acid | C18H32O2 | 280.24023027 | Glycine max |
C00001400 | 306-60-5 | Agmatine | C5H14N4 | 130.12184648 | Glycine max |
C00001403 | 462-94-2 | Cadaverine | C5H14N2 | 102.11569846 | Glycine max |
C00001428 | 110-60-1 | Putrescine | C4H12N2 | 88.1000484 | Glycine max |
C00001431 | 124-20-9 | Spermidine | C7H19N3 | 145.15789763 | Glycine max |
C00001435 | 51-67-2 | Tyramine | C8H11NO | 137.08406398 | Glycine max |
C00001555 | 535-83-1 | Trigonelline | C7H7NO2 | 137.04767848 | Glycine max |
C00001756 | 29700-20-7 | Perlolyrin | C16H12N2O2 | 264.08987764 | Glycine max |
C00002374 | 7084-24-4 | Cyanidin-3-O-glucoside | C21H21O11+ | 449.10838652 | Glycine max |
C00002507 | 550-79-8 | Afrormosin | C17H14O5 | 298.08412356 | Glycine max |
C00002510 | 491-80-5 | Biochanin A | C16H12O5 | 284.06847349 | Glycine max |
C00002514 | 479-13-0 | Coumestrol | C15H8O5 | 268.03717337 | Glycine max |
C00002518 | 552-66-9 | Daidzin | C21H20O9 | 416.11073224 | Glycine max |
C00002525 | 485-72-3 | Formononetin | C16H12O4 | 268.07355887 | Glycine max |
C00002526 | 446-72-0 | Genistein | C15H10O5 | 270.05282343 | Glycine max |
C00002528 | 529-59-9 | Genistin | C21H20O10 | 432.10564686 | Glycine max |
C00002530 | 57103-57-8 | (-)-Glyceollin I | C20H18O5 | 338.11542369 | Glycine max |
C00002531 | 67314-98-1 | (-)-Glyceollin II | C20H18O5 | 338.11542369 | Glycine max |
C00002532 | 69393-95-9 | (-)-Glycinol | C15H12O5 | 272.06847349 | Glycine max |
C00002559 | 13401-40-6 | Phaseolin | C20H18O4 | 322.12050906 | Glycine max |
C00002572 | 18979-00-5 | Sojagol | C20H16O5 | 336.09977362 | Glycine max |
C00002674 | 530-57-4 | Syringic acid | C9H10O5 | 198.05282343 | Glycine max |
C00002729 | 583-17-5 | o-Coumaric acid | C9H8O3 | 164.04734412 | Glycine max |
C00003552 | 78693-94-4 | Soyasaponin A1 | C59H96O29 | 1268.60372711 | Glycine max |
C00003553 | 51330-27-9 | Soyasaponin I | C48H78O18 | 942.51881569 | Glycine max |
C00003647 | 474-62-4 | Campesterol | C28H48O | 400.37051615 | Glycine max |
C00003648 | 57-88-5 | Cholesterol | C27H46O | 386.35486609 | Glycine max |
C00003650 | 469-38-5 | Cycloartenol | C30H50O | 426.38616622 | Glycine max |
C00003656 | 481-14-1 | Isofucosterol | C29H48O | 412.37051615 | Glycine max |
C00003672 | 83-46-5 | beta-Sitosterol | C29H50O | 414.38616622 | Glycine max |
C00003674 | 83-48-7 | Stigmasterol | C29H48O | 412.37051615 | Glycine max |
C00003737 | 638-95-9 | alpha-Amyrin | C30H50O | 426.38616622 | Glycine max |
C00003738 | 559-70-6 | beta-Amyrin | C30H50O | 426.38616622 | Glycine max |
C00003755 | 111-02-4 | All-trans-squalene | C30H50 | 410.39125159 | Glycine max |
C00003765 | 7488-99-5 | alpha-Carotene | C40H56 | 536.43820179 | Glycine max |
C00003776 | 127-40-2 | Lutein | C40H56O2 | 568.42803103 | Glycine max |
C00003787 | 126-29-4 | Violaxnathin | C40H56O4 | 600.41786028 | Glycine max |
C00004565 | 520-18-3 | Kaempferol | C15H10O6 | 286.04773805 | Glycine max |
C00005165 | 19895-95-5 | Kaempferol 3-O-sophoroside | C27H30O16 | 610.15338491 | Glycine max |
C00005166 | 22149-35-5 | Kaempferol 3-O-gentiobioside | C27H30O16 | 610.15338491 | Glycine max |
C00005167 | 32602-81-6 | Kaempferol 3-neohesperidoside | C27H30O15 | 594.15847029 | Glycine max |
C00005215 | 55696-59-8 | Kaempferol 3-glucosyl-(1->2)-gentiobioside | C33H40O21 | 772.20620834 | Glycine max |
C00005217 | 55696-58-7 | Kaempferol 3-(2G-glucosylrutinoside) | C33H40O20 | 756.21129372 | Glycine max |
C00005218 | 55780-30-8 | Kaempferol 3-(2G-rhamnosylgentiobioside) | C33H40O20 | 756.21129372 | Glycine max |
C00005219 | 55804-74-5 | Clitorin | C33H40O19 | 740.2163791 | Glycine max |
C00005409 | 18609-17-1 | Quercetin 3-O-sophoroside | C27H30O17 | 626.14829954 | Glycine max |
C00005411 | 7431-83-6 | Quercetin 3-gentiobioside | C27H30O17 | 626.14829954 | Glycine max |
C00005412 | 32453-36-4 | Quercetin 3-O-neohesperidoside | C27H30O16 | 610.15338491 | Glycine max |
C00005453 | 55696-56-5 | Quercetin 3-(2G-glucosylgentiobioside) | C33H40O22 | 788.20112297 | Glycine max |
C00005454 | 55696-55-4 | Quercetin 3-(2G-glucosylrutinoside) | C33H40O21 | 772.20620834 | Glycine max |
C00005455 | 55780-29-5 | Quercetin 3-(2G-rhamnosylgentiobioside) | C33H40O21 | 772.20620834 | Glycine max |
C00005456 | 55696-57-6 | Manghaslin | C33H40O20 | 756.21129372 | Glycine max |
C00006094 | 3681-99-0 | Puerarin | C21H20O9 | 416.11073224 | Glycine max |
C00006187 | 83151-90-0 | Isocarlinoside | C26H28O15 | 580.14282023 | Glycine max |
C00006400 | | 6-C-Glucopyranosyl-8-C-galactopyranosylgenkwanin | C28H32O15 | 608.17412036 | Glycine max |
C00006698 | 6906-38-3 | Myrtillin | C21H21O12 | 465.10330114 | Glycine max |
C00006722 | 6988-81-4 | Petunidin 3-O-beta-D-glucopyranoside | C22H23O12 | 479.1189512 | Glycine max |
C00006925 | 961-29-5 | Isoliquiritigenin | C15H12O4 | 256.07355887 | Glycine max |
C00007185 | 59122-93-9 | Neoisoliquiritigenin | C21H22O9 | 418.1263823 | Glycine max |
C00007233 | 25515-46-2 | Naringenin chalcone | C15H12O5 | 272.06847349 | Glycine max |
C00007246 | 3123-67-9 | GDP-Manose | C16H25N5O16P2 | 605.07715277 | Glycine max |
C00007247 | 463-40-1 | Linolenic acid | C18H30O2 | 278.2245802 | Glycine max |
C00007255 | 38476-27-6 | Phytyl pyrophosphate | C20H42O7P2 | 456.24057668 | Glycine max |
C00007280 | 30802-00-7 | p-Coumaroyl CoA | C30H42N7O18P3S | 913.15198779 | Glycine max |
C00007282 | 7200-26-2 | (S)-2,3-Epoxysqualene | C30H50O | 426.38616622 | Glycine max |
C00007292 | 190079-18-6 | DXP | C5H11O7P | 214.0242392 | Glycine max |
C00007294 | 358-72-5 | Dimethylally pyrophosphate | C5H12O7P2 | 246.00582572 | Glycine max |
C00007295 | 151435-51-7 | ME-2,4cPP | C5H12O9P2 | 277.99565496 | Glycine max |
C00007297 | 206440-72-4 | 2-C-Methyl-D-erythritol 4-phosphate | C5H13O7P | 216.03988926 | Glycine max |
C00007309 | 451-13-8 | Homogentisate | C8H8O4 | 168.04225874 | Glycine max |
C00007338 | 53078-86-7 | Arogenic acid | C10H13NO5 | 227.07937253 | Glycine max |
C00007363 | 119-13-1 | delta-Tocopherol | C27H46O2 | 402.34978071 | Glycine max |
C00007364 | 148-03-8 | beta-Tocopherol | C28H48O2 | 416.36543078 | Glycine max |
C00007365 | 7616-22-0 | gamma-Tocopherol | C28H48O2 | 416.36543078 | Glycine max |
C00007366 | 59-02-9 | alpha-Tocopherol | C29H50O2 | 430.38108084 | Glycine max |
C00007368 | 16910-32-0 | Obtusifoliol | C30H50O | 426.38616622 | Glycine max |
C00007388 | 1668-08-2 | L-Galactono-1,4-lactone | C6H10O6 | 178.04773805 | Glycine max |
C00007389 | 15978-07-1 | D-Mannose-1-phosphate | C6H13O9P | 260.02971851 | Glycine max |
C00007452 | 22372-29-8 | Sucrose 6-phosphate | C12H23O14P | 422.08254194 | Glycine max |
C00007455 | 6815-91-4 | GDP-L-galactose | C16H25N5O16P2 | 605.07715277 | Glycine max |
C00007468 | 97-59-6 | Allantoin | C4H6N4O3 | 158.04399009 | Glycine max |
C00007470 | 99-16-1 | Allantoic acid | C4H8N4O4 | 176.05455477 | Glycine max |
C00007531 | | 5-Hydroxyisourate | C5H4N4O4 | 184.02325465 | Glycine max |
C00007532 | | 2-Oxo-4-hydroxy-4-carboxy-5-ureidoimidazole | C5H6N4O5 | 202.03381933 | Glycine max |
C00007567 | | (E)-4-Hydroxy-3-methylbut-2-enyl diphosphate | C5H12O8P2 | 262.00074034 | Glycine max |
C00007620 | | 4-(Cytidine 5'-diphospho)-2-C-methyl-D-erythritol | C14H25N3O14P2 | 521.08117551 | Glycine max |
C00008024 | 5786-54-9 | Hispidol | C15H10O4 | 254.05790881 | Glycine max |
C00008041 | 20550-08-7 | Hispidol 6-glucoside | C21H20O9 | 416.11073224 | Glycine max |
C00009380 | 486-66-8 | Daidzein | C15H10O4 | 254.05790881 | Glycine max |
C00009382 | 486-63-5 | Isoformononetin | C16H12O4 | 268.07355887 | Glycine max |
C00009385 | 17817-31-1 | 4',6,7-Trihydroxyisoflavone | C15H10O5 | 270.05282343 | Glycine max |
C00009392 | 40957-83-3 | Glycitein | C16H12O5 | 284.06847349 | Glycine max |
C00009685 | 61080-23-7 | Glyceollin III | C20H18O5 | 338.11542369 | Glycine max |
C00009688 | 77979-22-7 | Glyceocarpin | C20H20O5 | 340.13107375 | Glycine max |
C00009689 | 77979-21-6 | Glyceollidin I | C20H20O5 | 340.13107375 | Glycine max |
C00009690 | 69393-94-8 | Glyceollin IV | C21H22O5 | 354.14672381 | Glycine max |
C00009691 | 78873-52-6 | Glyceofuran | C20H18O6 | 354.11033831 | Glycine max |
C00009692 | 78876-29-6 | 9-O-Methylglyceofuran | C21H20O6 | 368.12598837 | Glycine max |
C00009852 | 75187-63-2 | 8-Hydroxydaidzein | C15H10O5 | 270.05282343 | Glycine max |
C00009945 | 139051-61-9 | Senegalensin | C25H26O6 | 422.17293856 | Glycine max |
C00010078 | 71385-83-6 | Daidzein 6''-O-acetate | C23H22O10 | 458.12129692 | Glycine max |
C00010084 | 34307-23-8 | Demethyltexasin 4'-O-glucoside | C21H20O10 | 432.10564686 | Glycine max |
C00010089 | 40246-10-4 | Glycitein 7-O-glucoside | C22H22O10 | 446.12129692 | Glycine max |
C00010104 | 73566-30-0 | Genistin 6''-O-acetate | C23H22O11 | 474.11621155 | Glycine max |
C00010110 | 51011-05-3 | Genistein 7-O-beta-D-glucoside 6''-O-malonate | C24H22O13 | 518.10604079 | Glycine max |
C00010191 | 92631-72-6 | Coumestrol 3-O-glucoside | C21H18O10 | 430.0899968 | Glycine max |
C00018997 | 121927-96-6 | Dihydrodaidzin | C21H22O9 | 418.1263823 | Glycine max |
C00018998 | 441045-21-2 | Dihydrogenistin | C21H22O10 | 434.12129692 | Glycine max |
C00018999 | 441045-22-3 | 2'',6''-O-Diacetyloninin | C26H26O11 | 514.14751167 | Glycine max |
C00019000 | 441045-23-4 | (3beta,4alpha,22beta)-22-[[2-O-(6-Deoxy-alpha-L-mannopyranosyl)-alpha-L-arabinopyranosyl]oxy]-23-hydroxyolean-12-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1->2)-O-beta-D-galactopyranosyl-(1->2)-beta-D-glucopyranosiduronic acid | C59H96O26 | 1220.61898324 | Glycine max |
C00019001 | 441045-44-9 | (3beta,4alpha,22beta)-22-[[2-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-23-hydroxyolean-12-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1->2)-O-beta-D-galactopyranosyl-(1->2)-beta-D-glucopyranosiduronic acid | C60H98O27 | 1250.62954793 | Glycine max |
C00019002 | 181998-75-4 | 3-O-(beta-D-Glucopyranosyl)-soyasapogenol B | C36H60O8 | 620.42881889 | Glycine max |
C00019003 | 114590-20-4 | Soyasaponin V | C48H78O19 | 958.51373031 | Glycine max |
C00019004 | 78693-93-3 | Soyasaponin A2 | C53H86O24 | 1106.55090368 | Glycine max |
C00019079 | 714951-96-9 | Scanderone | C25H24O5 | 404.16237388 | Glycine max |
C00019122 | 134859-96-4 | Glycitein 6''-O-acetylglucoside | C24H24O11 | 488.13186161 | Glycine max |
C00019384 | 124590-31-4 | Daidzin 6''-O-malonate | C24H22O12 | 502.11112617 | Glycine max |
C00020214 | 34351-03-6 | 6a-Hydroxyphaseollin | C20H20O5 | 340.13107375 | Glycine max |
C00020217 | 487-24-1 | Pratol | C16H12O4 | 268.07355887 | Glycine max |
C00023743 | 313-04-2 | Desmosterol | C27H44O | 384.33921603 | Glycine max |
C00023756 | 4651-51-8 | Ergost-5-en-3beta-ol | C28H48O | 400.37051615 | Glycine max |
C00029593 | 2034-74-4 | 3beta-Hydroxystigmast-5-en-7-one | C29H48O2 | 428.36543078 | Glycine max |
C00029961 | 621-82-9 | Cinnamic acid | C9H8O2 | 148.0524295 | Glycine max |
C00030105 | 117210-14-7 | Dehydrosoyasaponin I | C48H76O18 | 940.50316563 | Glycine max |
C00032175 | 114297-20-0 | Soyacerebroside I | C40H75NO9 | 713.544183 | Glycine max |
C00040337 | 55319-36-3 | Soyasaponin II | C47H76O17 | 912.508251 | Glycine max Merrill. |
C00041026 | 501-30-4 | Kojic acid | C6H6O4 | 142.02660868 | Glycine max |
C00043018 | 6750-59-0 | Soyasapogenol E | C30H48O3 | 456.3603454 | Glycine max |
C00046784 | 78-79-5 | Isoprene | C5H8 | 68.06260026 | Glycine max |
C00048543 | 152505-09-4 | Soyasaponin Bg | C47H74O17 | 910.49260094 | Glycine max |
C00048545 | 108906-97-4 | Soyasaponin IV | C41H66O13 | 766.4503422 | Glycine max |
C00051252 | 123-76-2 | Levulinic acid | C5H8O3 | 116.04734412 | Glycine max |
C00052133 | 107-87-9 | FEMA 2842 | C5H10O | 86.07316494 | Glycine max |
C00052637 | 2463-63-0 | 2-Heptenal | C7H12O | 112.08881501 | Glycine max |
C00052716 | 156-39-8 | 4-hydroxyphenyl pyruvate | C9H8O4 | 180.04225874 | Glycine max |
C00053160 | 94-41-7 | Chalcone | C15H12O | 208.08881501 | Glycine max |
C00053174 | 5023-02-9 | Flavan-3,4-diol | C15H14O3 | 242.09429431 | Glycine max |
C00053428 | 15572-79-9 | L-Galactose | C6H12O6 | 180.06338812 | Glycine max |
C00053660 | 616-25-1 | pent-1-en-3-ol | C5H10O | 86.07316494 | Glycine max |
C00053791 | 508-01-0 | Soyasapogenol A | C30H50O4 | 474.37091008 | Glycine max |
C00053793 | 65892-76-4 | 22-Methoxy-13(18)-oleanene-3,24-diol | C31H52O3 | 472.39164553 | Glycine max |
C00054749 | 118194-13-1 | Acetylsoyasaponin A1 | C67H104O33 | 1436.64598585 | Glycine max |
C00054750 | 117230-32-7 | Acetylsoyasaponin A2 | C61H94O28 | 1274.59316242 | Glycine max |
C00054751 | 117210-16-9 | Acetylsoyasaponin A3 | C60H92O27 | 1244.58259774 | Glycine max |
C00054752 | 117230-33-8 | Acetylsoyasaponin A4 | C64H100O31 | 1364.62485648 | Glycine max |
C00054753 | 117230-34-9 | Acetylsoyasaponin A5 | C58H90O26 | 1202.57203305 | Glycine max |
C00054754 | 117230-35-0 | Acetylsoyasaponin A6 | C57H88O25 | 1172.56146836 | Glycine max |
C00054981 | 115074-93-6 | AS 1-3 | C40H75NO9 | 713.544183 | Glycine max |
C00056649 | 121254-96-4 | Glycinoprenol 9 | C45H80O | 636.62091717 | Glycine max |
C00056650 | 121254-97-5 | Glycinoprenol 10 | C50H88O | 704.68351743 | Glycine max |
C00056651 | 121254-98-6 | Glycinoprenol 11 | C55H96O | 772.74611768 | Glycine max |
C00056790 | 1002-33-1 | 1,3-Octadiene | C8H14 | 110.10955045 | Glycine max |
C00057777 | 114077-04-2 | Soyasaponin A3 | C48H78O19 | 958.51373031 | Glycine max |
C00057806 | 1187934-25-3 | Soyasaponin Bh | C48H76O19 | 956.49808025 | Glycine max |
C00057853 | 133882-74-3 | Soyasaponin Ac | C67H104O32 | 1420.65107123 | Glycine max |
C00057854 | 133898-74-5 | Soyasaponin Ad | C66H102O32 | 1406.63542117 | Glycine max |
C00057903 | 149636-85-1 | Soyasaponin betaa | C53H82O20 | 1038.53994506 | Glycine max |
C00057904 | 149636-86-2 | Soyasaponin gamma | C48H74O17 | 922.49260094 | Glycine max |
C00057905 | 149636-87-3 | Soyasaponin gammaa | C47H72O16 | 892.48203625 | Glycine max |
C00057914 | 152505-06-1 | Soyasaponin Ax | C63H98O30 | 1334.6142918 | Glycine max |
C00057915 | 152505-07-2 | Soyasaponin Bx | C47H76O18 | 928.50316563 | Glycine max |
C00057916 | 152505-08-3 | Soyasaponin Bf | C47H74O18 | 926.48751556 | Glycine max |
C00058124 | 510725-34-5 | Soystatin | C44H54N8O8S | 854.37853149 | Glycine max |
C00058135 | 55304-02-4 | Soyasaponin Bb' | C42H68O14 | 796.46090688 | Glycine max |
C00058231 | 859513-38-5 | Soyasphingosine A | C43H87NO5 | 697.65842489 | Glycine max |
C00058232 | 859513-39-6 | Soyasphingosine B | C42H85NO5 | 683.64277483 | Glycine max |