input word = C00012428

Metabolite InformationStructural formula
Name [1S-(1R*,2E,4R*,5R*,6E,10R*)]-3,7,11,11-Tetramethylbicyclo[8.1.0]undeca-2,6-diene-4,5-diol 4-acetate
Formula C17H26O3
Mw 278.1881947
CAS RN 86160-99-8
C_ID C00012428 ,
InChIKey CISPMYWQEQGJLM-WGEIWTTONA-N
InChICode InChI=1S/C17H26O3/c1-10-6-7-13-14(17(13,4)5)9-11(2)16(15(19)8-10)20-12(3)18/h8-9,13-16,19H,6-7H2,1-5H3/b10-8-,11-9-/t13-,14-,15-,16-/m0/s1
SMILES [C@H]12[C@@H](C1(C)C)/C=C(\[C@@H]([C@H](/C=C(\CC2)/C)O)OC(=O)C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCalypogeiaCalypogeia granulata Ref.
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