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CHEBI:132870 - (−)-homalomenol C

ChEBI IDCHEBI:132870
ChEBI Name(−)-homalomenol C
Stars
ASCII Name(-)-homalomenol C
DefinitionAn organic heterotricyclic compound and sesquiterpenoid that is 11-oxatricyclo[5.3.1.02,6]undecane-1,8-diol which is substituted by methyl groups at positions 5 and 8, and by an isopropyl group at position 5. The absolute stereochemistry is not known; it is either 1R,2S,5R,6R,7R,8R (as shown), or the enantiomer.
Last Modified15 August 2016
Submitterliuqingping
DownloadsMolfile
FormulaC15H26O3
Net Charge0
Average Mass254.370
Monoisotopic Mass254.18819
SMILES[H][C@]12O[C@](O)(CC[C@@]1(C)O)[C@@]1(C)CC[C@]([H])(C(C)C)[C@]12[H]
InChIInChI=1S/C15H26O3/c1-9(2)10-5-6-13(3)11(10)12-14(4,16)7-8-15(13,17)18-12/h9-12,16-17H,5-8H2,1-4H3/t10-,11+,12-,13+,14-,15-/m1/s1
InChIKeyDHUDRGOPTAAHRB-ARSDKDGVSA-N
Species of MetaboliteComponentSourceComments
Chimonanthus praecox (ncbitaxon:13419)
fruit (BTO:0000486) Article (Phytochem Lett., 2011, 4(3), 271-274)
leaf (BTO:0000713) Article (Phytochem Lett., 2011, 4(3), 271-274)
Homalomena aromatica (ncbitaxon:1804071) root (BTO:0001188) Article (Phytochemistry, 1992, 31(5), 1659-1661)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
(−)-homalomenol C (CHEBI:132870) has role plant metabolite (CHEBI:76924)
(−)-homalomenol C (CHEBI:132870) is a lactol (CHEBI:38131)
(−)-homalomenol C (CHEBI:132870) is a organic heterotricyclic compound (CHEBI:26979)
(−)-homalomenol C (CHEBI:132870) is a sesquiterpenoid (CHEBI:26658)
(−)-homalomenol C (CHEBI:132870) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
rel-(1R,2S,5R,6R,7R,8R)-5-isopropyl-2,8-dimethyl-11-oxatricyclo[5.3.1.02,6]undecane-1,8-diol
Synonym  Source
homalomenol CChEBI
Manual XrefsDatabases
C00033918KNApSAcK
Registry NumbersSources
Reaxys:5426860Reaxys