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cis-2-Carboxycyclohexyl-acetic acid

PropertiesImage
MNX_IDMNXM10979 Image of MNXM10979
referencechebi:35078
formulaC9H14O4
global charge0
mol weight186.207
InChIKeyGCGCKIUIBPEAQE-BQBZGAKWSA-N
InChIInChI=1S/C9H14O4/c10-8(11)5-6-3-1-2-4-7(6)9(12)13/h6-7H,1-5H2,(H,10,11)(H,12,13)/t6-,7-/m0/s1
SMILESO=C(O)C[C@@H]1CCCC[C@@H]1C(=O)O
MNX internals
InChI (mnx)InChI=1/C9H14O4/c10-8(11)5-6-3-1-2-4-7(6)9(12)13/h6-7H,1-5H2,(H,10,11)(H,12,13)/t6-,7-/m0/s1 Image of MNXM10979
SMILES (mnx)[CH2:1]1[CH2:2][CH2:4][C@H:7]([C:9](=[O:12])[OH:13])[C@H:6]([CH2:5][C:8](=[O:10])[OH:11])[CH2:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd09815
seedM:cpd09815
CHEBI:35078
chebi:35078
kegg.compound:C14112
keggC:C14112
GCGCKIUIBPEAQE-BQBZGAKWSA-L
GCGCKIUIBPEAQE-BQBZGAKWSA-N
cis-2-Carboxycyclohexyl-acetic acid

keggC:M_C14112
seedM:M_cpd09815
secondary/obsolete/fantasy identifier