input word = C00012302

Metabolite InformationStructural formula
Name [3aR-[3aR*,4R*(Z),6S*,9R*,10E,11aR*]]-9-(Acetyloxy)-2,3,3a,4,5,6,7,8,9,11a-decahydro-6-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 2-methyl-2-butenoic acid
3alpha-Acetoxytrichomoriolide
Formula C22H28O8
Mw 420.17841787
CAS RN 84886-56-6
C_ID C00012302 ,
InChIKey CTGVQTRUFDLXDN-SNCBHOIFNA-N
InChICode InChI=1S/C22H28O8/c1-7-11(2)20(25)30-17-10-22(6,27)18(24)9-15(28-14(5)23)12(3)8-16-19(17)13(4)21(26)29-16/h7-8,15-17,19,27H,4,9-10H2,1-3,5-6H3/b11-7-,12-8+/t15-,16+,17-,19+,22+/m1/s1
SMILES [C@@H]12[C@@H](OC(=O)C1=C)/C=C(/[C@@H](CC(=O)[C@@](C[C@H]2OC(=O)/C(=C\C)/C)(C)O)OC(=O)C)\C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTrichogoniopsis morii Ref.
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