input word = C00012905

Metabolite InformationStructural formula
Name [4aR-(4aalpha,5alpha,6alpha,8abeta)]-4,4a,5,6,7,8,8a,9-Octahydro-5-hydroxy-3,5,8a-trimethylnaphtho[2,3-b]furan-6-yl ester3-methylbutanoic acid
Formula C20H30O4
Mw 334.21440945
CAS RN 125164-76-3
C_ID C00012905 ,
InChIKey XQLBOODLMKZFEY-HRSLERGPNA-N
InChICode InChI=1S/C20H30O4/c1-12(2)8-18(21)24-17-6-7-19(4)10-15-14(13(3)11-23-15)9-16(19)20(17,5)22/h11-12,16-17,22H,6-10H2,1-5H3/t16-,17-,19-,20+/m1/s1
SMILES [C@]1([C@H]2[C@](CC[C@H]1OC(=O)CC(C)C)(Cc1c(C2)c(co1)C)C)(O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEpaltes gariepina Ref.
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