input word = C00012691

Metabolite InformationStructural formula
Name [1R-(1alpha,4alpha,4aalpha,7beta,8abeta)]-4-Bromo-7-chlorodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1-naphthalenol
Formula C15H26BrClO
Mw 336.08555606
CAS RN 68690-87-9
C_ID C00012691 ,
InChIKey OPQUHETURHZWCC-MNBPDBLXNA-N
InChICode InChI=1S/C15H26BrClO/c1-10(2)15(17)8-7-13(3)11(9-15)14(4,18)6-5-12(13)16/h10-12,18H,5-9H2,1-4H3/t11-,12-,13-,14+,15+/m0/s1
SMILES [C@]1(CC[C@@H]([C@@]2([C@@H]1C[C@](CC2)(C(C)C)Cl)C)Br)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Laurencia spp. Ref.
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