input word = C00024117

Metabolite InformationStructural formula
Name Sargatriol
Formula C27H38O4
Mw 426.2770097
CAS RN 55831-27-1
C_ID C00024117 ,
InChIKey NLMRJUCJUFPPBR-INXHXEBFNA-N
InChICode InChI=1S/C27H38O4/c1-18(2)9-7-10-19(3)15-24(29)25(30)20(4)11-8-13-27(6)14-12-22-17-23(28)16-21(5)26(22)31-27/h9,11-12,14-17,24-25,28-30H,7-8,10,13H2,1-6H3/b19-15+,20-11+/t24-,25-,27-/m1/s1
SMILES c1c(cc2c(c1C)O[C@@](C=C2)(CC/C=C(/[C@H]([C@@H](/C=C(\C)/CCC=C(C)C)O)O)\C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataSargassaceaeSargassum tortile Ref.
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OrganismSargassum tortile
ReferenceKikuchi,Chem.Pharm.Bull.,23,(1975),690-692

Kikuchi,Chem.Pharm.Bull.,31,(1983),106-113