input word = C00049691

Metabolite InformationStructural formula
Name 1-Deacetoxyalgoane
(+)-1-Deacetoxyalgoane
Formula C15H25Br2ClO2
Mw 429.99098355
CAS RN 251450-53-0
C_ID C00049691 ,
InChIKey DLURQEMMMGZLDY-IENYIDCHNA-N
InChICode InChI=1S/C15H25Br2ClO2/c1-12(2)9(16)7-11(19)14(12,4)15(20)6-5-13(3,18)10(17)8-15/h9-11,19-20H,5-8H2,1-4H3/t9-,10-,11+,13-,14+,15+/m0/s1
SMILES [C@H]1([C@@](CC[C@@](C1)([C@]1(C([C@H](C[C@H]1O)Br)(C)C)C)O)(C)Cl)Br
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAplysiidaeAplysia dactylomela Ref.
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