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Benzyl-6-hydroxy-2-cyclohexene-on-oyl

PropertiesImage
MNX_IDMNXM8328 Image of MNXM8328
referencechebi:195575
formulaC14H14O4
global charge0
mol weight246.262
InChIKeyILTCAPLRBIEGDX-UHFFFAOYSA-N
InChIInChI=1S/C14H14O4/c15-12-8-4-5-9-14(12,17)13(16)18-10-11-6-2-1-3-7-11/h1-3,5-7,9,17H,4,8,10H2
SMILESO=C1CCC=CC1(O)C(=O)OCC1=CC=CC=C1
MNX internals
InChI (mnx)InChI=1/C14H14O4/c15-12-8-4-5-9-14(12,17)13(16)18-10-11-6-2-1-3-7-11/h1-3,5-7,9,17H,4,8,10H2/t14? Image of MNXM8328
SMILES (mnx)[CH:1]1=[CH:2][CH:6]=[C:11]([CH2:10][O:18][C:13]([C:14]2([OH:17])[CH:9]=[CH:5][CH2:4][CH2:8][C:12]2=[O:15])=[O:16])[CH:7]=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:195575
chebi:195575
ILTCAPLRBIEGDX-UHFFFAOYSA-N
Benzyl-6-hydroxy-2-cyclohexene-on-oyl
benzyl 1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate

metacyc.compound:CPD-13175
metacycM:CPD-13175
ILTCAPLRBIEGDX-UHFFFAOYSA-N
benzyl 1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate
hmdb:HMDB0304271
ILTCAPLRBIEGDX-UHFFFAOYSA-N
benzyl-6-hydroxy-2-cyclohexene-on-oyl
Benzyl 1-hydroxy-6-oxocyclohex-2-ene-1-carboxylic acid
Benzyl-HCH
benzyl 1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate

seed.compound:cpd23768
seedM:cpd23768
ILTCAPLRBIEGDX-UHFFFAOYSA-N
benzyl-6-hydroxy-2-cyclohexene-on-oyl
benzyl-HCH

seedM:M_cpd23768
secondary/obsolete/fantasy identifier