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4-amino-4-deoxychorismate

PropertiesImage
MNX_IDMNXM1458 Image of MNXM1458
referencechebi:58406
formulaC10H10NO5
global charge-1
mol weight224.192
InChIKeyOIUJHGOLFKDBSU-HTQZYQBOSA-M
InChIInChI=1S/C10H11NO5/c1-5(9(12)13)16-8-4-6(10(14)15)2-3-7(8)11/h2-4,7-8H,1,11H2,(H,12,13)(H,14,15)/p-1/t7-,8-/m1/s1
SMILESC=C(O[C@@H]1C=C(C(=O)[O-])C=C[C@H]1[NH3+])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C10H11NO5/c1-5(9(12)13)16-8-4-6(10(14)15)2-3-7(8)11/h2-4,7-8H,1,11H2,(H,12,13)(H,14,15)/t7-,8-/m1/s1 Image of MNXM1458
SMILES (mnx)[CH2:1]=[C:5]([C:9](=[O:12])[OH:13])[O:16][C@@H:8]1[CH:4]=[C:6]([C:10](=[O:14])[OH:15])[CH:2]=[CH:3][C@H:7]1[NH2:11]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)8
in models (compartimentalized) 5
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58406
chebi:58406
OIUJHGOLFKDBSU-HTQZYQBOSA-M 		4-amino-4-deoxychorismate
(3R,4R)-4-ammonio-3-[(1-carboxylatovinyl)oxy]cyclohexa-1,5-diene-1-carboxylate
4-amino-4-deoxychorismate(1-)

sabiork.compound:13425
sabiorkM:13425
kegg.compound:C11355
keggC:C11355
OIUJHGOLFKDBSU-HTQZYQBOSA-L
OIUJHGOLFKDBSU-HTQZYQBOSA-N 		4-Amino-4-deoxychorismate
ADC

bigg.metabolite:4adcho
biggM:4adcho
metacyc.compound:4-AMINO-4-DEOXYCHORISMATE
metacycM:4-AMINO-4-DEOXYCHORISMATE
vmhM:4adcho
vmhmetabolite:4adcho
OIUJHGOLFKDBSU-HTQZYQBOSA-M
OIUJHGOLFKDBSU-UHFFFAOYSA-M 		4-amino-4-deoxychorismate

CHEBI:35181
chebi:35181
OIUJHGOLFKDBSU-HTQZYQBOSA-L 		4-amino-4-deoxychorismate(2-)
(3R,4R)-4-amino-3-[(1-carboxylatoethenyl)oxy]cyclohexa-1,5-diene-1-carboxylate
4-Amino-4-deoxychorismate
ADC
hmdb:HMDB0304170
OIUJHGOLFKDBSU-HTQZYQBOSA-N 		4-amino-4-deoxychorismate
(3R,4R)-4-amino-3-[(1-carboxyeth-1-en-1-yl)oxy]cyclohexa-1,5-diene-1-carboxylic acid
4-Amino-4-deoxychorismate
4-amino-4-Deoxychorismic acid
4-amino-4-deoxychorismic acid
ADC

CHEBI:18198
chebi:18198
OIUJHGOLFKDBSU-HTQZYQBOSA-N 		4-amino-4-deoxychorismic acid
(3R,4R)-4-amino-3-[(1-carboxyethenyl)oxy]cyclohexa-1,5-diene-1-carboxylic acid
ADC

seed.compound:cpd08210
seedM:cpd08210
OIUJHGOLFKDBSU-HTQZYQBOSA-M 		ADC
4-Amino-4-deoxychorismate
4-amino-4-deoxychorismate
4adcho

chebi:11956
chebi:1943
chebi:35180
biggM:M_4adcho
keggC:M_C11355
seedM:M_cpd08210
vmhM:M_4adcho 		secondary/obsolete/fantasy identifier