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L-quinate

MNXM474 is deprecated and here replaced by MNXM736788
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM736788 Image of MNXM736788
referencechebi:29751
formulaC7H11O6
global charge-1
mol weight191.159
InChIKeyAAWZDTNXLSGCEK-WYWMIBKRSA-M
InChIInChI=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)/p-1/t3-,4-,5-,7+/m1/s1
SMILESO=C([O-])[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](O)C1
MNX internals
InChI (mnx)InChI=1/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+/m1/s1 Image of MNXM736788
SMILES (mnx)[CH2:1]1[C@@H:3]([OH:8])[C@@H:5]([OH:10])[C@H:4]([OH:9])[CH2:2][C@@:7]1([C:6](=[O:11])[OH:12])[OH:13]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)32
in models (compartimentalized) 5
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:29751
chebi:29751
AAWZDTNXLSGCEK-WYWMIBKRSA-M 		L-quinate
(-)-quinate
(1S,3R,4S,5R)-1,3,4,5-tetrahydroxycyclohexanecarboxylate
1L-1(OH),3,4/5-Tetrahydroxycyclohexanecarboxylate
Quinate

sabiork.compound:27312
sabiorkM:27312
AAWZDTNXLSGCEK-WYWMIBKRSA-N 		(-)-Quinate

CHEBI:17521
chebi:17521
AAWZDTNXLSGCEK-WYWMIBKRSA-N 		(-)-quinic acid
(-)-Quinic acid
(1S,3R,4S,5R)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid
1L-1(OH),3,4/5-tetrahydroxycyclohexanecarboxylic acid
Chinic acid
D-Quinic acid
Kinic acid
L-Quinic acid
Quinic acid

metacyc.compound:QUINATE
metacycM:QUINATE
AAWZDTNXLSGCEK-WYWMIBKRSA-M 		L-quinate
(-)-quinate
(-)-quinic acid
(1S,3R,4S,5R)-1,3,4,5-tetrahydroxycyclohexanecarboxylate

bigg.metabolite:quin
biggM:quin
AAWZDTNXLSGCEK-WYWMIBKRSA-M 		Quinate

seed.compound:cpd00248
seedM:cpd00248
AAWZDTNXLSGCEK-WYWMIBKRSA-M 		Quinate
(-)-Quinic acid
(-)-quinate
(-)-quinic acid
(1S,3R,4S,5R)-1,3,4,5-tetrahydroxycyclohexanecarboxylate
Chinic acid
Kinic acid
L-Quinate
L-Quinic acid
L-quinate
Quinic acid
quin-kt

kegg.compound:C00296
keggC:C00296
AAWZDTNXLSGCEK-WYWMIBKRSA-N 		Quinate
(-)-Quinic acid
Chinic acid
Kinic acid
L-Quinate
L-Quinic acid
Quinic acid

vmhM:quint
vmhmetabolite:quint
AAWZDTNXLSGCEK-WYWMIBKRSA-M 		Quinate
(1S,3R,4S,5R)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid

sabiork.compound:5034
sabiorkM:5034
AAWZDTNXLSGCEK-WYWMIBKRSA-N 		Quinate
Chinic acid
Kinic acid
L-Quinate
L-Quinic acid
Quinic acid
hmdb:HMDB0003072
AAWZDTNXLSGCEK-WYWMIBKRSA-N 		Quinic acid
(-)-Quinate
(-)-Quinic acid
(1alpha,3R,4alpha,5R)-1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid
(1alpha,3R,4alpha,5R)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid
1,3,4,5-Tetrahydroxycyclohexane-1-carboxylic acid
1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid
Chinate
Chinic acid
D-(-)-Quinic acid
D-Quinate
D-Quinic acid
Hexahydro-1,3,4,5-tetrahydroxybenzoic acid
Kinate
Kinic acid
Quinate

hmdb:HMDB03072
chebi:15000
chebi:26489
chebi:26492
chebi:8715
biggM:M_quin
keggC:M_C00296
seedM:M_cpd00248
vmhM:M_quint 		secondary/obsolete/fantasy identifier