input word = C00031557

Metabolite InformationStructural formula
Name Acanthokoreoic acid A
Formula C20H30O4
Mw 334.21440945
CAS RN 616895-25-1
C_ID C00031557 ,
InChIKey QWUJSFMPRYDMES-FDNQBOIHNA-N
InChICode InChI=1S/C20H30O4/c1-5-17(2)9-10-20(24)13(12-17)14(21)11-15-18(3,16(22)23)7-6-8-19(15,20)4/h5,13,15,24H,1,6-12H2,2-4H3,(H,22,23)/t13-,15+,17+,18+,19+,20+/m0/s1
SMILES C=C[C@]1(C)CC[C@@]2(O)[C@@H](C1)C(=O)CC1[C@](C)(C(=O)O)CCC[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaeAcanthopanax koreanum Ref.
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