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CHEBI:203694 - 5alpha,10alpha,11-trihydroxyamorphan-3-one

ChEBI IDCHEBI:203694
ChEBI Name5alpha,10alpha,11-trihydroxyamorphan-3-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O4
Net Charge0
Average Mass270.369
Monoisotopic Mass270.18311
SMILESC[C@H]1C(=O)C[C@H]2[C@@H]([C@@H]1O)[C@@H](C(C)(C)O)CC[C@@]2(C)O
InChIInChI=1S/C15H26O4/c1-8-11(16)7-10-12(13(8)17)9(14(2,3)18)5-6-15(10,4)19/h8-10,12-13,17-19H,5-7H2,1-4H3/t8-,9-,10-,12-,13+,15+/m0/s1
InChIKeyZASMGHSREUVBCZ-PBUJQPSHSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies M491 (ncbitaxon:345410) - PubMed (17315965)
ChEBI Ontology
Outgoing Relation(s)
5alpha,10alpha,11-trihydroxyamorphan-3-one (CHEBI:203694) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(3R,4S,4aS,5S,8R,8aS)-4,8-dihydroxy-5-(2-hydroxypropan-2-yl)-3,8-dimethyl-1,3,4,4a,5,6,7,8a-octahydronaphthalen-2-one
Manual XrefsDatabases
17214554ChemSpider