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CHEBI:198526 - Sarcographol

ChEBI IDCHEBI:198526
ChEBI NameSarcographol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O3
Net Charge0
Average Mass252.354
Monoisotopic Mass252.17254
SMILESC[C@H]1[C@H](O)CCC2=C[C@@H]3OC[C@@](C)(O)[C@@H]3C[C@@]21C
InChIInChI=1S/C15H24O3/c1-9-12(16)5-4-10-6-13-11(7-14(9,10)2)15(3,17)8-18-13/h6,9,11-13,16-17H,4-5,7-8H2,1-3H3/t9-,11+,12+,13-,14+,15+/m0/s1
InChIKeyAFLFYVGFIJZIKQ-MMKLUXSESA-N
Species of MetaboliteComponentSourceComments
Sarcographa tricosa (ncbitaxon:1232551) - PubMed (22285621)
ChEBI Ontology
Outgoing Relation(s)
Sarcographol (CHEBI:198526) is a naphthofuran (CHEBI:39270)
IUPAC Name 
(3S,3aR,4aR,5R,6R,9aS)-3,4a,5-trimethyl-2,3a,4,5,6,7,8,9a-octahydrobenzo[][1]benzouran-3,6-diol
Manual XrefsDatabases
78441972ChemSpider