input word = C00059738

Metabolite InformationStructural formula
Name (3beta,20beta)-3-(Formyloxy)-11-oxo-olean-12-en-29-oic acid
Formula C31H46O5
Mw 498.33452458
CAS RN 1361090-68-7
C_ID C00059738
InChIKey SZCBEZBTGMAMQI-BDANYOJNSA-N
InChICode InChI=1S/C31H46O5/c1-26(2)22-8-11-31(7)24(29(22,5)10-9-23(26)36-18-32)21(33)16-19-20-17-28(4,25(34)35)13-12-27(20,3)14-15-30(19,31)6/h16,18,20,22-24H,8-15,17H2,1-7H3,(H,34,35)/t20-,22-,23-,24+,27+,28-,29-,30+,31+/m0/s1
SMILES CC1(C(=O)O)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(OC=O)C(C)(C)C5CCC43C)C2C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza inflata Ref.
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