input word = C00042348

Metabolite InformationStructural formula
Name Cativic acid methyl ester
Formula C21H36O2
Mw 320.27153039
CAS RN 1438-55-7
C_ID C00042348 ,
InChIKey LWPPDVAQDDYKML-WRTCALDJNA-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/h9,15,17-18H,7-8,10-14H2,1-6H3/t15-,17-,18-,21-/m0/s1
SMILES C1CC([C@H]2[C@@](C1)([C@H](C(=CC2)C)CC[C@@H](CC(=O)OC)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCopaifera cearensis Ref.
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