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5-deoxy-5-amino-3-dehydroshikimate

Properties

Image

Occurences in reactions

MNX_ID

MNXM5553

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

formula

C₇H₉NO₄

charge

mass

171.05316

reference

InChIKey

NTKDYXWKDJOXSZ-XINAWCOVSA-N

InChI

InChI=1S/C7H9NO4/c8-4-1-3(7(11)12)2-5(9)6(4)10/h2,4,6,10H,1,8H2,(H,11,12)/t4-,6+/m1/s1

SMILES

[NH3+][C@@H]1CC(C(=O)[O-])=CC(=O)[C@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:71963 chebi:71963	5-deoxy-5-amino-3-dehydroshikimate (4S,5R)-5-azaniumyl-4-hydroxy-3-oxocyclohex-1-ene-1-carboxylate 5-amino-5-deoxy-3-dehydroshikimic acid zwitterion 5-ammonio-5-deoxy-3-dehydroshikimate
kegg.compound:C12108 keggC:C12108	5-Amino-5-deoxy-3-dehydroshikimate 5-Deoxy-5-amino-3-dehydroshikimic acid AminoDHS
metacyc.compound:CPD-10230 metacycM:CPD-10230	5-amino-5-deoxy-3-dehydroshikimate 5-deoxy-5-amino-3-dehydroshikimic acid aminoDHS
CHEBI:29514 chebi:29514	5-amino-5-deoxy-3-dehydroshikimic acid (4S,5R)-5-amino-4-hydroxy-3-oxocyclohex-1-ene-1-carboxylic acid 5-Deoxy-5-amino-3-dehydroshikimic acid AminoDHS
seed.compound:cpd08890 seedM:cpd08890	AminoDHS 5-Amino-5-deoxy-3-dehydroshikimate 5-Deoxy-5-amino-3-dehydroshikimic acid 5-amino-5-deoxy-3-dehydroshikimate 5-deoxy-5-amino-3-dehydroshikimate 5-deoxy-5-amino-3-dehydroshikimic acid aminoDHS
keggC:M_C12108 seedM:M_cpd08890	secondary/obsolete/fantasy identifier