input word = C00021626

Metabolite InformationStructural formula
Name Isoobtusol
Formula C15H23Br2ClO
Mw 411.98041887
CAS RN 73494-23-2
C_ID C00021626 ,
InChIKey JPQFUHCOKXIWBB-LHODOWMJNA-N
InChICode InChI=1S/C15H23Br2ClO/c1-9-7-10(19)12(16)13(2,3)15(9)6-5-14(4,17)11(18)8-15/h10-12,19H,1,5-8H2,2-4H3/t10-,11-,12-,14-,15+/m0/s1
SMILES [C@@H]1([C@H](CC(=C)[C@@]2(C1(C)C)CC[C@@]([C@H](C2)Cl)(Br)C)O)Br
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Laurencia majuscula Ref.
--Laurencia obtusa Ref.
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OrganismLaurencia majuscula
ReferenceVairappan, et al., Phytochemistry, 58, (2001), 291