input word = C00063141

Metabolite InformationStructural formula
Name [1S-[1alpha(E),2alpha,4abeta,8aalpha]]-5-(Decahydro-2,5,5,8a-tetramethyl-1-naphthalenyl)-3-methyl-2-pentenoic acid, methyl ester
Formula C21H36O2
Mw 320.27153039
CAS RN 85134-72-1
C_ID C00063141
InChIKey KUFCXCJOXPZWCV-FORAKQBMSA-N
InChICode InChI=1S/C21H36O2/c1-15(14-19(22)23-6)8-10-17-16(2)9-11-18-20(3,4)12-7-13-21(17,18)5/h14,16-18H,7-13H2,1-6H3/b15-14+/t16-,17-,18-,21+/m0/s1
SMILES COC(=O)C=C(C)CCC1C(C)CCC2C(C)(C)CCCC12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeColophospermum mopane Ref.
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