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CHEBI:223966 - Xylarinorditerpene C

ChEBI IDCHEBI:223966
ChEBI NameXylarinorditerpene C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H30O2
Net Charge0
Average Mass290.447
Monoisotopic Mass290.22458
SMILESC[C@@]12CCO[C@H]1C1=CC[C@H]3[C@H](CO)CCC[C@]3(C)[C@H]1CC2
InChIInChI=1S/C19H30O2/c1-18-9-7-16-14(17(18)21-11-10-18)5-6-15-13(12-20)4-3-8-19(15,16)2/h5,13,15-17,20H,3-4,6-12H2,1-2H3/t13-,15-,16-,17-,18+,19-/m0/s1
InChIKeyLADQDFYODAXMCF-ZKFKSPHGSA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - PubMed (31961677)
ChEBI Ontology
Outgoing Relation(s)
Xylarinorditerpene C (CHEBI:223966) is a oxa-steroid (CHEBI:50917)
IUPAC Name 
[(3aR,5aS,6R,9aS,9bR,11aR)-9a,11a-dimethyl-1,2,3a,5,5a,6,7,8,9,9b,10,11-dodecahydronaphtho[1,2-g][1]benzouran-6-yl]methanol