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CHEBI:132900 - (+)-homalomenol A

ChEBI IDCHEBI:132900
ChEBI Name(+)-homalomenol A
Stars
DefinitionA sesquiterpenoid that is perhydroindane which is substituted by a (2-methylprop-1-en-1-yl) group at position 1, methyl groups at positions 3a and 7, and hydroxy groups at positions 4 and 7 (the 1R,3aR,4R,7S,7aR stereoisomer).
Last Modified15 August 2016
Submitterliuqingping
DownloadsMolfile
FormulaC15H26O2
Net Charge0
Average Mass238.371
Monoisotopic Mass238.19328
SMILES[H][C@@]12[C@@H](C=C(C)C)CC[C@@]1(C)[C@H](O)CC[C@]2(C)O
InChIInChI=1S/C15H26O2/c1-10(2)9-11-5-7-14(3)12(16)6-8-15(4,17)13(11)14/h9,11-13,16-17H,5-8H2,1-4H3/t11-,12-,13-,14+,15+/m1/s1
InChIKeyFKMCEEHVCIIPLE-ZSAUSMIDSA-N
Species of MetaboliteComponentSourceComments
Homalomena aromatica (ncbitaxon:1804071) root (BTO:0001188) PubMed (1368861)
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 occulta (ncbitaxon:714477) aerial part (BTO:0001658) PubMed (17511005)
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 A (CHEBI:132900) has role plant metabolite (CHEBI:76924)
(+)-homalomenol A (CHEBI:132900) is a carbobicyclic compound (CHEBI:36785)
(+)-homalomenol A (CHEBI:132900) is a diol (CHEBI:23824)
(+)-homalomenol A (CHEBI:132900) is a olefinic compound (CHEBI:78840)
(+)-homalomenol A (CHEBI:132900) is a secondary alcohol (CHEBI:35681)
(+)-homalomenol A (CHEBI:132900) is a sesquiterpenoid (CHEBI:26658)
(+)-homalomenol A (CHEBI:132900) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
(1R,3aR,4R,7S,7aR)-3a,7-dimethyl-1-(2-methylprop-1-en-1-yl)octahydro-1H-indene-4,7-diol
Synonym  Source
homalomenol AChEBI
Registry NumbersSources
Reaxys:5810527Reaxys
CAS:145400-03-9ChemIDplus
Citations