input word = C00034601

Metabolite InformationStructural formula
Name Methyl galbanate
Formula C25H32O5
Mw 412.22497413
CAS RN 53696-76-7
C_ID C00034601 ,
InChIKey VEPJENAVBBECGU-UHFFFAOYNA-N
InChICode InChI=1S/C25H32O5/c1-16-12-13-25(4,21(18(16)3)10-6-17(2)24(27)28-5)15-29-20-9-7-19-8-11-23(26)30-22(19)14-20/h7-9,11,14,17,21H,6,10,12-13,15H2,1-5H3/t17-,21-,25+/m1/s1
SMILES c1(ccc2c(c1)oc(=O)cc2)OC[C@]1([C@@H](C(=C(CC1)C)C)CC[C@H](C(=O)OC)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula assa-foetida Ref.
PlantaeApiaceaeFerula szowitsiana Ref.
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