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3-methoxybenzoate

PropertiesImage
MNX_IDMNXM36603 Image of MNXM36603
referencechebi:180538
formulaC8H7O3
global charge-1
mol weight151.141
InChIKeyXHQZJYCNDZAGLW-UHFFFAOYSA-M
InChIInChI=1S/C8H8O3/c1-11-7-4-2-3-6(5-7)8(9)10/h2-5H,1H3,(H,9,10)/p-1
SMILESCOC1=CC(C(=O)[O-])=CC=C1
MNX internals
InChI (mnx)InChI=1/C8H8O3/c1-11-7-4-2-3-6(5-7)8(9)10/h2-5H,1H3,(H,9,10) Image of MNXM36603
SMILES (mnx)[CH3:1][O:11][C:7]1=[CH:4][CH:2]=[CH:3][C:6]([C:8](=[O:9])[OH:10])=[CH:5]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:180538
chebi:180538
XHQZJYCNDZAGLW-UHFFFAOYSA-M
3-methoxybenzoate
3-methoxybenzoic acid anion
m-methoxybenzoate
hmdb:HMDB0032606
XHQZJYCNDZAGLW-UHFFFAOYSA-N
3-Methoxybenzoic acid
3-Anisic acid
3-Methoxy-benzoate
3-Methoxy-benzoic acid
3-Methoxybenzoate
3-methoxybenzoic acid
BENZOIC ACID,3-methoxy
FEMA 3944
M-methoxybenzoic acid
m-Anisic acid
m-Anisic acid, 8ci
m-Methoxybenzoic acid
m-Methylsalicylic acid

metacyc.compound:CPD-12220
metacycM:CPD-12220
seed.compound:cpd23301
seedM:cpd23301
XHQZJYCNDZAGLW-UHFFFAOYSA-M
3-methoxybenzoate
3-methoxybenzoic acid

CHEBI:88458
chebi:88458
XHQZJYCNDZAGLW-UHFFFAOYSA-N
3-methoxybenzoic acid
3-anisic acid
3-methoxy-benzoic acid
FEMA 3944
benzoic acid, 3-methoxy-
m-anisic acid
m-methoxybenzoic acid
m-methylsalicylic acid

sabiork.compound:20993
sabiorkM:20993
m-Methoxybenzoate

hmdb:HMDB32606
seedM:M_cpd23301
secondary/obsolete/fantasy identifier