CHEBI:17671 - 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde
ChEBI ID CHEBI:17671
ChEBI ASCII Name 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:12093, CHEBI:2023, CHEBI:20529
Supplier Information
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Formulae C9H11NO6
C9H11NO6
Net Charge 0
Average Mass 229.18670
Monoisotopic Mass 229.05864
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)/b5-1-,7-2+/t6-/m0/s1
InChIKey OAPFPZKGGMKELA-WEBQFGJISA-N
SMILES N[C@@H](C\C(C=O)=C\C=C(\O)C(O)=O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde (CHEBI:17671) is a (L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde (CHEBI:18634)
5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde (CHEBI:17671) is conjugate acid of 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde(1−) (CHEBI:58227)
Incoming 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde(1−) (CHEBI:58227) is conjugate base of 5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde (CHEBI:17671)
IUPAC Name
(2E,4Z,7S)-7-amino-5-formyl-2-hydroxyocta-2,4-dienedioic acid
Synonym Source
5-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde KEGG COMPOUND
Manual Xref Database
C04797 KEGG COMPOUND
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Last Modified
02 December 2010