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N~2~-(3-Carboxypropanoyl)ornithine

HCID 920
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Basic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
899816-95-6
Standard SMILES
NCCCC(NC(=O)CCC(=O)O)C(=O)O
InChIKey
VWXQFHJBQHTHMK-UHFFFAOYSA-N
Molecular formula
C9H16N2O5
Average molar mass
232.23 g/mol
Monoisotopic mass
232.10592162

Overview

N2-Succinyl-L-ornithine is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).

Names & identifiers

Preferred name
N~2~-(3-Carboxypropanoyl)ornithine
IUPAC
5-amino-2-(3-carboxypropanoylamino)pentanoic acid

Names & synonyms

N~2~-(3-Carboxypropanoyl)ornithineDTXSID70274291RefChem:1093449DTXCID00225771899816-95-6

Database identifiers

CAS
899816-95-6
PubChem CID
920
DTXSID
DTXSID70274291

Properties

Computed structural properties

XLogP
-3.9
Topological polar surface area
130 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
16
Formal charge
0
Complexity
267

Related reactions

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Compound notes

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