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CHEBI:227756 - 4beta-methyl-15-oxa-14beta-androstane-7-ene-4alpha-hydroxyl

ChEBI IDCHEBI:227756
ChEBI Name4beta-methyl-15-oxa-14beta-androstane-7-ene-4alpha-hydroxyl
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H30O2
Net Charge0
Average Mass290.447
Monoisotopic Mass290.22458
SMILESC[C@@]12CCO[C@@H]1C1=CC[C@@H]3[C@](C)(CCC[C@@]3(C)O)[C@H]1CC2
InChIInChI=1S/C19H30O2/c1-17-10-7-14-13(16(17)21-12-11-17)5-6-15-18(14,2)8-4-9-19(15,3)20/h5,14-16,20H,4,6-12H2,1-3H3/t14-,15+,16+,17+,18+,19+/m0/s1
InChIKeyFWTKVIBNWCLLSZ-DOQFWFFUSA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - PubMed (24890390)
ChEBI Ontology
Outgoing Relation(s)
4beta-methyl-15-oxa-14beta-androstane-7-ene-4alpha-hydroxyl (CHEBI:227756) is a hydroxy steroid (CHEBI:35350)
IUPAC Name 
(3aS,5aR,6R,9aR,9bR,11aR)-6,9a,11a-trimethyl-2,3a,5,5a,7,8,9,9b,10,11-decahydro-1H-naphtho[1,2-g][1]benzouran-6-ol
Manual XrefsDatabases
78442332ChemSpider