input word = C00021633

Metabolite InformationStructural formula
Name Prepacifenol epoxide
Formula C15H21Br2ClO3
Mw 441.95459805
CAS RN 55304-01-3
C_ID C00021633 ,
InChIKey AHEAISCIGHPMGI-MGLTUXSLNA-N
InChICode InChI=1S/C15H21Br2ClO3/c1-11(2)14(5-7(16)12(3,18)6-8(14)19)13(4)9(20-13)10-15(11,17)21-10/h7-10,19H,5-6H2,1-4H3/t7-,8-,9+,10+,12-,13+,14-,15+/m0/s1
SMILES [C@]12([C@@H]([C@@H]3[C@@]([C@@]4(C1(C)C)C[C@@H]([C@@](C[C@@H]4O)(C)Cl)Br)(C)O3)O2)Br
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAplysiidaeAplysia californica Ref.
AnimaliaAplysiidaeAplysia dactylomela Ref.
--Laurencia johnstonii Ref.
--Laurencia spp. Ref.
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OrganismLaurencia spp.
ReferenceVairappan,Phytochem.,69,(2008),2490