input word = C00013615

Metabolite InformationStructural formula
Name Apigenin 7-(3''-p-coumaroylglucoside)
Formula C30H26O12
Mw 578.1424263
CAS RN
C_ID C00013615 ,
InChIKey JEOJQDYZOZKMAG-JVFMYNAINA-N
InChICode InChI=1S/C30H26O12/c31-14-24-27(37)29(42-25(36)10-3-15-1-6-17(32)7-2-15)28(38)30(41-24)39-19-11-20(34)26-21(35)13-22(40-23(26)12-19)16-4-8-18(33)9-5-16/h1-13,24,27-34,37-38H,14H2/b10-3-/t24-,27-,28-,29+,30-/m1/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1ccc(cc1)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)OC(=O)/C=C\c1ccc(cc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeStachys aegyptiaca Ref.
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