input word = C00013919

Metabolite InformationStructural formula
Name Isorhamnetin 3-(2G-rhamnosylrutinoside)-7-rhamnoside
Quercetin 3'-methyl ether
3-(2G-rhamnosylrutinoside)-7-rhamnoside
3-[(O-6-Deoxy-alpha-L-mannopyranosyl-(1->2)-O-[6-deoxy-alpha-L-mannopyranosyl-(1->6)]-beta-D-glucopyranosyl)oxy]-7-[(6-deoxy-alpha-L-mannopyranosyl)oxy]-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one
Formula C40H52O24
Mw 916.28485259
CAS RN 154171-32-1
C_ID C00013919 ,
InChIKey RFGSFRBMLXKAEM-PVITXCSKNA-N
InChICode InChI=1S/C40H52O24/c1-11-22(43)27(48)31(52)37(57-11)56-10-20-25(46)30(51)36(64-39-33(54)29(50)24(45)13(3)59-39)40(62-20)63-35-26(47)21-17(42)8-15(60-38-32(53)28(49)23(44)12(2)58-38)9-19(21)61-34(35)14-5-6-16(41)18(7-14)55-4/h5-9,11-13,20,22-25,27-33,36-46,48-54H,10H2,1-4H3/t11-,12-,13-,20-,22-,23-,24-,25-,27+,28+,29+,30-,31-,32-,33-,36+,37+,38-,39-,40-/m0/s1
SMILES c1c(cc(c(c1)O)OC)c1oc2c(c(=O)c1O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)CO[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)O)O[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)c(cc(c2)O[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeChrysothamnus nauseosus Ref.
PlantaeAsteraceaeChrysothamnus viscidiflorus Ref.
PlantaeRosaceaeColeogyne ramosissima Ref.
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