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CHEBI:198450 - Diaporol B

ChEBI IDCHEBI:198450
ChEBI NameDiaporol B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O4
Net Charge0
Average Mass270.369
Monoisotopic Mass270.18311
SMILESCC1(C)C(=O)CC[C@]2(C)[C@@H](CO)[C@](C)(O)CC[C@@]12O
InChIInChI=1S/C15H26O4/c1-12(2)11(17)5-6-13(3)10(9-16)14(4,18)7-8-15(12,13)19/h10,16,18-19H,5-9H2,1-4H3/t10-,13-,14-,15-/m1/s1
InChIKeyUVZJNSNTYDRWNA-JUDXGUMMSA-N
Species of MetaboliteComponentSourceComments
Diaporthespecies (ncbitaxon:1756133) - PubMed (23006147)
ChEBI Ontology
Outgoing Relation(s)
Diaporol B (CHEBI:198450) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
(4aR,5S,6R,8aS)-6,8a-dihydroxy-5-(hydroxymethyl)-1,1,4a,6-tetramethyl-4,5,7,8-tetrahydro-3H-naphthalen-2-one
Manual XrefsDatabases
28666954ChemSpider