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3-acetylamino-4-hydroxybenzoate

PropertiesImage
MNX_IDMNXM14512 Image of MNXM14512
referencechebi:140533
formulaC9H8NO4
global charge-1
mol weight194.166
InChIKeyBXBFVCYLJXGOGI-UHFFFAOYSA-M
InChIInChI=1S/C9H9NO4/c1-5(11)10-7-4-6(9(13)14)2-3-8(7)12/h2-4,12H,1H3,(H,10,11)(H,13,14)/p-1
SMILESCC(=O)NC1=CC(C(=O)[O-])=CC=C1O
MNX internals
InChI (mnx)InChI=1/C9H9NO4/c1-5(11)10-7-4-6(9(13)14)2-3-8(7)12/h2-4,12H,1H3,(H,10,11)(H,13,14) Image of MNXM14512
SMILES (mnx)[CH3:1][C:5](=[N:10][C:7]1=[C:8]([OH:12])[CH:3]=[CH:2][C:6]([C:9](=[O:13])[OH:14])=[CH:4]1)[OH:11]
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

CHEBI:140533
chebi:140533
BXBFVCYLJXGOGI-UHFFFAOYSA-M
3-acetylamino-4-hydroxybenzoate
3-(acetylamino)-4-hydroxybenzoate
3-acetamido-4-hydroxybenzoate

CHEBI:140603
chebi:140603
BXBFVCYLJXGOGI-UHFFFAOYSA-N
3-acetamido-4-hydroxybenzoic acid
3-(acetylamino)-4-hydroxybenzoic acid
3-acetylamino-4-hydroxybenzoic acid

metacyc.compound:CPD-14877
metacycM:CPD-14877
BXBFVCYLJXGOGI-UHFFFAOYSA-M
3-acetylamino-4-hydroxybenzoate
3-acetamido-4-hydroxybenzoate
3-acetylamino-4-hydroxybenzoic acid

seed.compound:cpd31708
seedM:cpd31708
BXBFVCYLJXGOGI-UHFFFAOYSA-M
3-acetylamino-4-hydroxybenzoate
3-acetylamino-4-hydroxybenzoic acid

seedM:M_cpd31708
secondary/obsolete/fantasy identifier