input word = C00041337

Metabolite InformationStructural formula
Name Angeliferulate
(+)-Angeliferulate
Formula C21H24O8
Mw 404.14711774
CAS RN 879496-41-0
C_ID C00041337 ,
InChIKey IYGJNXKQEYRFJG-WEVVVXLNNA-N
InChICode InChI=1S/C21H24O8/c1-26-18-10-13(4-7-15(18)22)5-9-20(25)29-12-17(24)21(28-3)14-6-8-16(23)19(11-14)27-2/h4-11,17,21-24H,12H2,1-3H3/b9-5+/t17-,21+/m1/s1
SMILES COc1cc(/C=C/C(=O)OCC(O)C(OC)c2ccc(O)c(OC)c2)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica sinensis Ref.
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