input word = C00012536

Metabolite InformationStructural formula
Name [1S-(1alpha,2beta,5alpha)]-4-Bromo-5-(1,2-dimethylbicyclo[3.1.0]hex-2-yl)-2-methylphenol acetate
Cyclolaurenol acetate
Formula C17H21BrO2
Mw 336.07249281
CAS RN 103456-68-4
C_ID C00012536 ,
InChIKey GXVCGMDUNXZCMZ-UHFFFAOYNA-N
InChICode InChI=1S/C17H21BrO2/c1-10-7-14(18)13(8-15(10)20-11(2)19)16(3)6-5-12-9-17(12,16)4/h7-8,12H,5-6,9H2,1-4H3/t12-,16+,17+/m0/s1
SMILES [C@@]12([C@](CC[C@H]1C2)(c1c(cc(c(c1)OC(=O)C)C)Br)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAplysiidaeAplysia dactylomela Ref.
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