2,3,4,5-Tetrahydro-2,6-pyridinedicarboxylic acid
Grundinformationen
- CAS
2353-17-5- Standard-SMILES
O=C(O)C1=NC(C(=O)O)CCC1- InChIKey
CXMBCXQHOXUCEO-UHFFFAOYSA-N- Summenformel
- C7H9NO4
- Durchschnittliche Molmasse
- 171,15 g/mol
- Monoisotopische Masse
- 171,05315777
Überblick
2,3,4,5-tetrahydrodipicolinic acid is an amino dicarboxylic acid consisting of 2,3,4,5-tetrahydrodipyridine having two carboxy groups at the 2- and 6-positions. It has a role as an Escherichia coli metabolite. It is a tetrahydropyridine and an amino dicarboxylic acid. It is functionally related to a dipicolinic acid. It is a conjugate acid of a 2,3,4,5-tetrahydrodipicolinate(2-).
Namen und Bezeichner
- Bevorzugter Name
- 2,3,4,5-Tetrahydro-2,6-pyridinedicarboxylic acid
- IUPAC
- 2,3,4,5-tetrahydropyridine-2,6-dicarboxylic acid
- Englischer Name
- 2,3,4,5-tetrahydro-2,6-pyridinedicarboxylic acid
- Summenformel
- C7H9NO4
- Molmasse
- 171.15
Namen und Synonyme
2353-17-5THDPA2,3,4,5-Tetrahydro-2,6-pyridinedicarboxylic acid2,3,4,5-Tetrahydro-2,6-dipicolinateRefChem:812542,3,4,5-tetrahydropyridine-2,6-dicarboxylic acid2,3,4,5-tetrahydrodipicolinic acid2,6-Pyridinedicarboxylic acid, 2,3,4,5-tetrahydro-2,6-Pyridinedicarboxylicacid, 2,3,4,5-tetrahydro-SCHEMBL346633CHEBI:32976DTXSID70946284
Weitere Namen anzeigen
AKOS026745456Q27115166
Datenbank-Bezeichner
- CAS
2353-17-5- PubChem CID
- 632
- DTXSID
DTXSID70946284- ChEBI
CHEBI:32976- Nikkaji
- J793.978G
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -0,2
- Polarare Oberfläche (TPSA)
- 87 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 246
Chemie und Industrie
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Ergänzende Hinweise
DefinitionChEBI: An amino dicarboxylic acid consisting of 2,3,4,5-tetrahydrodipyridine having two carboxy groups at the 2- and 6-positions.
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