input word = C00004164

Metabolite InformationStructural formula
Name Apigenin 7-glucuronide-4'-rhamnoside
Formula C27H28O15
Mw 592.14282023
CAS RN 58970-78-8
C_ID C00004164 ,
InChIKey IYSVAHHNEAGSMC-LMRYZCCHNA-N
InChICode InChI=1S/C27H28O15/c1-9-18(30)19(31)22(34)26(38-9)39-11-4-2-10(3-5-11)15-8-14(29)17-13(28)6-12(7-16(17)41-15)40-27-23(35)20(32)21(33)24(42-27)25(36)37/h2-9,18-24,26-28,30-35H,1H3,(H,36,37)/t9-,18-,19+,20+,21-,22-,23-,24+,26-,27+/m0/s1
SMILES CC1O[C@@H](Oc2ccc(-c3cc(=O)c4c(O)cc(O[C@@H]5O[C@@H](C(=O)O)[C@@H](O)C(O)C5O)cc4o3)cc2)[C@@H](O)C(O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeConocephalaceaeConocephalum conicum Ref.
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