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CHEBI:220894 - Scrobicalol

ChEBI IDCHEBI:220894
ChEBI NameScrobicalol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O2
Net Charge0
Average Mass234.339
Monoisotopic Mass234.16198
SMILESC[C@@H]1C[C@@H](CO)C(C=O)=CC2=C1CC(C)(C)C2
InChIInChI=1S/C15H22O2/c1-10-4-12(8-16)13(9-17)5-11-6-15(2,3)7-14(10)11/h5,9-10,12,16H,4,6-8H2,1-3H3/t10-,12+/m1/s1
InChIKeyGSICEBAAGIKPSQ-PWSUYJOCSA-N
Species of MetaboliteComponentSourceComments
Lactarius scrobiculatus (ncbitaxon:93011) - DOI (10.1016/s0040-4039(00)61796-3)
ChEBI Ontology
Outgoing Relation(s)
Scrobicalol (CHEBI:220894) is a primary alcohol (CHEBI:15734)
IUPAC Name 
(6R,8R)-6-(hydroxymethyl)-2,2,8-trimethyl-3,6,7,8-tetrahydro-1H-azulene-5-carbaldehyde
Manual XrefsDatabases
10317323ChemSpider