(-)-homalomenol C (CHEBI:132870)

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ChEBI Name	(−)-homalomenol C

ChEBI ID	CHEBI:132870

ChEBI ASCII Name	(-)-homalomenol C

Definition	An organic heterotricyclic compound and sesquiterpenoid that is 11-oxatricyclo[5.3.1.0^2,6]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.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	qingping liu

Supplier Information

Download	Molfile XML SDF

Formula

C15H26O3

Net Charge

Average Mass

254.366

Monoisotopic Mass

254.18819

InChI

InChI=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

InChIKey

DHUDRGOPTAAHRB-ARSDKDGVSA-N

SMILES

[C@@]12([C@](CC[C@]([C@@]3([C@]1([C@](CC3)(C(C)C)[H])[H])C)(O2)O)(C)O)[H]

Metabolite of Species	Details
Chimonanthus praecox (NCBI:txid13419)	Found in fruit (BTO:0000486). See: Phytochem Lett., 2011, 4(3), 271-274
Chimonanthus praecox (NCBI:txid13419)	Found in leaf (BTO:0000713). See: Phytochem Lett., 2011, 4(3), 271-274
Homalomena aromatica (NCBI:txid1804071)	Found in root (BTO:0001188). See: Phytochemistry, 1992, 31(5), 1659-1661

Roles Classification
Biological Role(s):	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	(−)-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[5.3.1.0^2,6]undecane-1,8-diol

Synonym	Source
homalomenol C	ChEBI

Registry Number	Type	Source
5426860	Reaxys Registry Number	Reaxys

Last Modified

15 August 2016