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CHEBI:208026 - Cladosporisteroid C

ChEBI IDCHEBI:208026
ChEBI NameCladosporisteroid C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H34O4
Net Charge0
Average Mass374.521
Monoisotopic Mass374.24571
SMILESCOC1(OC)CC[C@@]2(C)[C@H](C1)C(=O)C=C1[C@@H]2CC[C@]2(C)[C@@H](C(C)=O)CC[C@@H]12
InChIInChI=1S/C23H34O4/c1-14(24)16-6-7-17-15-12-20(25)19-13-23(26-4,27-5)11-10-22(19,3)18(15)8-9-21(16,17)2/h12,16-19H,6-11,13H2,1-5H3/t16-,17+,18+,19-,21-,22-/m1/s1
InChIKeyAXWFOQMABDNGAW-UQXDBHSJSA-N
Species of MetaboliteComponentSourceComments
Cladosporium (ncbitaxon:5498) - PubMed (29223616)
ChEBI Ontology
Outgoing Relation(s)
Cladosporisteroid C (CHEBI:208026) is a 20-oxo steroid (CHEBI:36885)
IUPAC Name 
(5S,9R,10R,13S,14R,17S)-17-acetyl-3,3-dimethoxy-10,13-dimethyl-2,4,5,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
Manual XrefsDatabases
71048972ChemSpider