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CHEBI:186011 - (+)-Beyerol

ChEBI IDCHEBI:186011
ChEBI Name(+)-Beyerol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H32O3
Net Charge0
Average Mass320.473
Monoisotopic Mass320.23514
SMILES[H][C@]12CC[C@@]34C=C[C@@](CO)(CC[C@@]3([H])[C@]1(C)CC[C@@H](O)[C@@]2(C)CO)C4
InChIInChI=1S/C20H32O3/c1-17-6-5-16(23)18(2,12-21)14(17)4-8-20-10-9-19(11-20,13-22)7-3-15(17)20/h9-10,14-16,21-23H,3-8,11-13H2,1-2H3/t14-,15-,16+,17+,18-,19-,20-/m0/s1
InChIKeyHMKFWGVTZPRBQX-QMNUTNMBSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
(+)-Beyerol (CHEBI:186011) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(1R,4S,5R,6R,9S,10S,13R)-5,13-bis(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadec-14-en-6-ol
Manual XrefsDatabases
4508988ChemSpider