input word = C00020868

Metabolite InformationStructural formula
Name [3aS-[3aalpha,4alpha,5beta(Z),9beta,9aalpha,9bbeta]]-4-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-5-yl ester 2-methyl-2-butenoic acid
Formula C22H26O7
Mw 402.16785319
CAS RN 117274-11-0
C_ID C00020868 ,
InChIKey PIBICCCSPLZQQU-CPRBNGIMNA-N
InChICode InChI=1S/C22H26O7/c1-7-10(2)20(24)28-17-11(3)14-8-9-22(6,26)16(14)18-15(12(4)21(25)29-18)19(17)27-13(5)23/h7-9,15-19,26H,4H2,1-3,5-6H3/b10-7-/t15-,16-,17+,18-,19+,22+/m0/s1
SMILES C=C1C(=O)O[C@H]2[C@H]1[C@@H](OC(C)=O)[C@H](OC(=O)/C(C)=CC)C(C)=C1C=C[C@](C)(O)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHeliopsis helianthoides Ref.
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