input word = C00020743

Metabolite InformationStructural formula
Name [1R-(1alpha,4beta,4abeta,6alpha,8aalpha)]-6-(Acetyloxy)-4-ethoxy-1,2,3,4,4a,5,6,8a-octahydro-4,7-dimethyl-a-methylene-1-naphthaleneacetic acid methyl ester
Formula C20H30O5
Mw 350.20932407
CAS RN 91896-92-3
C_ID C00020743 ,
InChIKey IHTPDLSMQBZELS-QGCFSHSANA-N
InChICode InChI=1S/C20H30O5/c1-7-24-20(5)9-8-15(13(3)19(22)23-6)16-10-12(2)18(11-17(16)20)25-14(4)21/h10,15-18H,3,7-9,11H2,1-2,4-6H3/t15-,16+,17+,18-,20+/m0/s1
SMILES C=C(C(=O)OC)[C@@H]1CC[C@@](C)(OCC)[C@@H]2C[C@H](OC(C)=O)C(C)=C[C@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeLeucanthemopsis pulverulenta Ref.
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