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5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde

Properties

Image

Occurences in reactions

MNX_ID

MNXM2493

	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	0

formula

C₉H₁₀NO₆

charge

-1

mass

228.17884

reference

InChIKey

OAPFPZKGGMKELA-WEBQFGJISA-M

InChI

InChI=1S/C9H11NO6/c10-6(8(13)14)3-5(4-11)1-2-7(12)9(15)16/h1-2,4,6,12H,3,10H2,(H,13,14)(H,15,16)/p-1/b5-1-,7-2+/t6-/m0/s1

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58227 chebi:58227	5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde (2E,4Z,7S)-7-ammonio-5-formyl-2-hydroxyocta-2,4-dienedioate (2E,4Z,7S)-7-azaniumyl-5-formyl-2-hydroxyocta-2,4-dienedioate 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde anion 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde(1-)
metacyc.compound:CPD-252 metacycM:CPD-252	2,3-seco-dopa 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde AHMS
kegg.compound:C04797 keggC:C04797	5-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde
seed.compound:cpd02915 seedM:cpd02915	5-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde 2,3-seco-dopa 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde AHMS
CHEBI:17671 chebi:17671 lipidmaps:LMFA01170073 lipidmapsM:LMFA01170073	5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde (2E,4Z,7S)-7-amino-5-formyl-2-hydroxyocta-2,4-dienedioic acid 5-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde
chebi:12093 chebi:2023 chebi:20529 keggC:M_C04797 seedM:M_cpd02915	secondary/obsolete/fantasy identifier