input word = C00023338

Metabolite InformationStructural formula
Name Cativic acid
(13S)-7-Labden-15-oic acid
Formula C20H34O2
Mw 306.25588033
CAS RN 468-82-6
C_ID C00023338 ,
InChIKey FEENGIUGOPKQTF-BXQSSONCNA-N
InChICode InChI=1S/C20H34O2/c1-14(13-18(21)22)7-9-16-15(2)8-10-17-19(3,4)11-6-12-20(16,17)5/h8,14,16-17H,6-7,9-13H2,1-5H3,(H,21,22)/t14-,16-,17-,20-/m0/s1
SMILES C1CC([C@H]2[C@@](C1)([C@H](C(=CC2)C)CC[C@@H](CC(=O)O)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePrioria copaifera Ref.
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OrganismPrioria copaifera
ReferenceKalman,J. Am. Chem. Soc.,60,(1938),1423