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(2S)-2-amino-4-deoxychorismate

PropertiesImage
MNX_IDMNXM2042 Image of MNXM2042
referencechebi:58792
formulaC10H10NO5
global charge-1
mol weight224.192
InChIKeyOKLGKGPAZUNROU-YUMQZZPRSA-M
InChIInChI=1S/C10H11NO5/c1-5(9(12)13)16-7-4-2-3-6(8(7)11)10(14)15/h2-4,7-8H,1,11H2,(H,12,13)(H,14,15)/p-1/t7-,8-/m0/s1
SMILESC=C(O[C@H]1C=CC=C(C(=O)[O-])[C@@H]1[NH3+])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C10H11NO5/c1-5(9(12)13)16-7-4-2-3-6(8(7)11)10(14)15/h2-4,7-8H,1,11H2,(H,12,13)(H,14,15)/t7-,8-/m0/s1 Image of MNXM2042
SMILES (mnx)[CH:1]1=[CH:4][CH:5]=[C:3]([C:8]([CH3:9])=[CH2:10])[O:15]([OH:16])[C@@H:2]1[CH2:6][C:7]([N:11](=[O:13])[OH:14])=[O:12]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)7
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58792
chebi:58792
OKLGKGPAZUNROU-YUMQZZPRSA-M 		(2S)-2-amino-4-deoxychorismate
(5S,6S)-6-azaniumyl-5-[(1-carboxylatoethenyl)oxy]cyclohexa-1,3-diene-1-carboxylate
2-azaniumyl-2-deoxyisochorismate

metacyc.compound:CPD-9517
metacycM:CPD-9517
OKLGKGPAZUNROU-YUMQZZPRSA-M 		(2S)-2-amino-4-deoxy-chorismate
(2S)-2-amino-2-deoxy-isochorismate
(2S)-2-amino-2-deoxy-isochorismic acid
(2S)-2-amino-4-deoxy-chorismic acid
2-amino-2-deoxyisochorismate
2-amino-4-deoxychorismate
ADIC

seed.compound:cpd18037
seedM:cpd18037 		2-Amino-2-deoxyisochorismate

kegg.compound:C18054
keggC:C18054
OKLGKGPAZUNROU-YUMQZZPRSA-N 		2-Amino-2-deoxyisochorismate
(2S)-2-Amino-4-deoxychorismate
(2S,3S)-3-(1-Carboxyvinyloxy)-2,3-dihydroanthranilate

sabiork.compound:31538
sabiorkM:31538
OKLGKGPAZUNROU-YUMQZZPRSA-N 		2-Amino-2-deoxyisochorismic acid
2-Amino-2-deoxyisochorismate

seed.compound:cpd17073
seedM:cpd17073
OKLGKGPAZUNROU-YUMQZZPRSA-M 		2-amino-2-deoxyisochorismic acid
(2S)-2-Amino-4-deoxychorismate
(2S)-2-amino-2-deoxy-isochorismate
(2S)-2-amino-2-deoxy-isochorismic acid
(2S)-2-amino-4-deoxy-chorismate
(2S)-2-amino-4-deoxy-chorismic acid
2-Amino-2-deoxyisochorismate
2-amino-2-deoxy-isochorismate
2-amino-2-deoxy-isochorismic acid
2-amino-4-deoxy-chorismate
2-amino-4-deoxy-chorismic acid
a4dic

CHEBI:49197
chebi:49197
OKLGKGPAZUNROU-YUMQZZPRSA-N 		2-amino-2-deoxyisochorismic acid
(2S)-2-Amino-4-deoxychorismate
(5S,6S)-6-amino-5-[(1-carboxyethenyl)oxy]cyclohexa-1,3-diene-1-carboxylic acid
(5S,6S)-6-amino-5-[(1-carboxyvinyl)oxy]cyclohexa-1,3-diene-1-carboxylic acid
ADIC

keggC:M_C18054
seedM:M_cpd17073
seedM:M_cpd18037 		secondary/obsolete/fantasy identifier