input word = C00012906

Metabolite InformationStructural formula
Name [4aR-[4aalpha,5alpha,6alpha(Z),8abeta]]-4,4a,5,6,7,8,8a,9-Octahydro-5-hydroxy-3,5,8a-trimethylnaphtho[2,3-b]furan-6-yl ester 2-methyl-2-butenoic acid
Formula C20H28O4
Mw 332.19875938
CAS RN 125164-77-4
C_ID C00012906 ,
InChIKey PWBVCFWIHKMIKC-SHFKWNIBNA-N
InChICode InChI=1S/C20H28O4/c1-6-12(2)18(21)24-17-7-8-19(4)10-15-14(13(3)11-23-15)9-16(19)20(17,5)22/h6,11,16-17,22H,7-10H2,1-5H3/b12-6-/t16-,17-,19-,20+/m1/s1
SMILES [C@]1([C@H]2[C@](CC[C@H]1OC(=O)/C(=C\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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OrganismEpaltes gariepina
ReferenceZdero,Phytochem.,28,(1989),3097