CHEBI:216877 - (3R)-10,12-dihydroxy-3-methyl-3,4,5,6,7,8-hexahydro-2-benzoxecin-1-one

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ChEBI Name (3R)-10,12-dihydroxy-3-methyl-3,4,5,6,7,8-hexahydro-2-benzoxecin-1-one
ChEBI ID CHEBI:216877
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H18O4
Net Charge 0
Average Mass 250.294
Monoisotopic Mass 250.12051
InChI InChI=1S/C14H18O4/c1-9-5-3-2-4-6-10-7-11(15)8-12(16)13(10)14(17)18-9/h7-9,15-16H,2-6H2,1H3/t9-/m1/s1
InChIKey CNIDCRMKWWDVSA-SECBINFHSA-N
SMILES O=C1O[C@@H](CCCCCC=2C1=C(O)C=C(O)C2)C
Metabolite of Species Details
Chaetosphaeronema hispidulum (NCBI:txid565418) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (3R)-10,12-dihydroxy-3-methyl-3,4,5,6,7,8-hexahydro-2-benzoxecin-1-one (CHEBI:216877) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name
(3R)-10,12-dihydroxy-3-methyl-3,4,5,6,7,8-hexahydro-2-benzoxecin-1-one