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Isoniazid alpha-ketoglutaric acid

PropertiesImage
MNX_IDMNXM11916 Image of MNXM11916
referencechebi:80619
formulaC11H11N3O5
global charge0
mol weight265.225
InChIKeyCCBSJXHUMYNUKH-MDWZMJQESA-N
InChIInChI=1S/C11H11N3O5/c15-9(16)2-1-8(11(18)19)13-14-10(17)7-3-5-12-6-4-7/h3-6H,1-2H2,(H,14,17)(H,15,16)(H,18,19)/b13-8+
SMILESO=C(O)CC/C(=N\NC(=O)C1=CC=NC=C1)C(=O)O
MNX internals
InChI (mnx)InChI=1/C11H11N3O5/c15-9(16)2-1-8(11(18)19)13-14-10(17)7-3-5-12-6-4-7/h3-6H,1-2H2,(H,14,17)(H,15,16)(H,18,19)/b13-8+ Image of MNXM11916
SMILES (mnx)[CH2:1]([CH2:2][C:9](=[O:15])[OH:16])/[C:8]([C:11](=[O:18])[OH:19])=[N:13]\[NH:14][C:10]([C:7]1=[CH:4][CH:6]=[N:12][CH:5]=[CH:3]1)=[O:17]
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:cpd16429
seedM:cpd16429
CHEBI:80619
chebi:80619
kegg.compound:C16625
keggC:C16625
CCBSJXHUMYNUKH-MDWZMJQESA-L
CCBSJXHUMYNUKH-MDWZMJQESA-N
Isoniazid alpha-ketoglutaric acid
hmdb:HMDB0060663
CCBSJXHUMYNUKH-MDWZMJQESA-N
Isoniazid alpha-ketoglutaric acid
(2E)-2-{[(pyridin-4-yl)formamido]imino}pentanedioic acid
Isoniazid a-ketoglutarate
Isoniazid a-ketoglutaric acid
Isoniazid alpha-ketoglutarate
isoniazid alpha-ketoglutaric acid

hmdb:HMDB60663
keggC:M_C16625
seedM:M_cpd16429
secondary/obsolete/fantasy identifier