input word = C00013745

Metabolite InformationStructural formula
Name Kaempferol 3-xylosyl-(1->6)-glucosyl-(1->2)-rhamnoside
Helieianeoside A
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[(O-beta-D-xylopyranosyl-(1->6)-O-beta-D-glucopyranosyl-(1->2)-6-deoxy-alpha-L-mannopyranosyl)oxy]-4H-1-benzopyran-4-one
Formula C32H38O19
Mw 726.20072904
CAS RN 496066-82-1
C_ID C00013745 ,
InChIKey IJTSOAGIKDWSEB-FXLQDNFONA-N
InChICode InChI=1S/C32H38O19/c1-10-19(37)24(42)29(51-31-26(44)23(41)21(39)17(49-31)9-46-30-25(43)20(38)15(36)8-45-30)32(47-10)50-28-22(40)18-14(35)6-13(34)7-16(18)48-27(28)11-2-4-12(33)5-3-11/h2-7,10,15,17,19-21,23-26,29-39,41-44H,8-9H2,1H3/t10-,15-,17+,19-,20+,21+,23-,24+,25+,26+,29-,30+,31-,32-/m0/s1
SMILES c1c(ccc(c1)O)c1oc2c(c(=O)c1O[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@@H]1[C@@H]([C@@H]([C@H](CO1)O)O)O)O)O)O)c(cc(c2)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeProteaceaeHelicia nilagirica Ref.
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