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CHEBI:213444 - (+)-(1R,3R,6S,7S,8R,11S)-3,8,12-trihydroxy-alpha-muurolene

ChEBI IDCHEBI:213444
ChEBI Name(+)-(1R,3R,6S,7S,8R,11S)-3,8,12-trihydroxy-alpha-muurolene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O3
Net Charge0
Average Mass252.354
Monoisotopic Mass252.17254
SMILESCC1=C[C@@H]2[C@@H]([C@H](C)CO)[C@@H](O)C=C(C)[C@@H]2C[C@H]1O
InChIInChI=1S/C15H24O3/c1-8-5-14(18)15(10(3)7-16)12-4-9(2)13(17)6-11(8)12/h4-5,10-18H,6-7H2,1-3H3/t10-,11+,12+,13-,14+,15-/m1/s1
InChIKeyVBJDHIYJUUBFBR-ULXLPNHUSA-N
Species of MetaboliteComponentSourceComments
Trichaptum (ncbitaxon:40451) - PubMed (24837356)
ChEBI Ontology
Outgoing Relation(s)
(+)-(1R,3R,6S,7S,8R,11S)-3,8,12-trihydroxy-alpha-muurolene (CHEBI:213444) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1S,2R,4aR,6R,8aS)-1-[(2S)-1-hydroxypropan-2-yl]-4,7-dimethyl-1,2,4a,5,6,8a-hexahydronaphthalene-2,6-diol
Manual XrefsDatabases
78442356ChemSpider