CHEBI:36124 - (+)-quinic acid

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ChEBI Name (+)-quinic acid
ChEBI ID CHEBI:36124
Definition The (+)-enantiomer of quinic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C7H12O6
Net Charge 0
Average Mass 192.16658
Monoisotopic Mass 192.06339
InChI InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5-,7+/m0/s1
InChIKey AAWZDTNXLSGCEK-DRMQKGJZSA-N
SMILES O[C@H]1C[C@@](O)(C[C@H](O)[C@H]1O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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.
(via quinic acid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (+)-quinic acid (CHEBI:36124) is a quinic acid (CHEBI:26493)
(+)-quinic acid (CHEBI:36124) is enantiomer of (−)-quinic acid (CHEBI:17521)
Incoming 4-O-trans-caffeoylquinic acid (CHEBI:75491) has functional parent (+)-quinic acid (CHEBI:36124)
5-O-cis-caffeoylquinic acid (CHEBI:75489) has functional parent (+)-quinic acid (CHEBI:36124)
(−)-quinic acid (CHEBI:17521) is enantiomer of (+)-quinic acid (CHEBI:36124)
IUPAC Names
(1R,3S,4R,5S)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid
1D-1(OH),3,4/5-tetrahydroxycyclohexanecarboxylic acid
Registry Numbers Types Sources
2212410 Beilstein Registry Number Beilstein
2212410 Reaxys Registry Number Reaxys
Last Modified
08 July 2014