Chemical Components in the PDB

pdbe.org/chem
spacer

AHO : Summary

Code

AHO

One-letter code

A

Molecule name

N-ACETYL-N-HYDROXY-L-ORNITHINE

Synonyms

5-(ACETYL-HYDROXY-AMINO)-2-AMINO-PENTANOIC ACID

Systematic names

ProgramVersionName
ACDLabs 10.04 N~5~-acetyl-N~5~-hydroxy-L-ornithine
OpenEye OEToolkits 1.5.0 (2S)-2-amino-5-(ethanoyl-hydroxy-amino)pentanoic acid

Formula

C7 H14 N2 O4

Formal charge

0

Molecular weight

190.197 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 O=C(N(O)CCCC(N)C(=O)O)C
SMILES CACTVS 3.341 CC(=O)N(O)CCC[CH](N)C(O)=O
SMILES OpenEye OEToolkits 1.5.0 CC(=O)N(CCCC(C(=O)O)N)O
Canonical SMILES CACTVS 3.341 CC(=O)N(O)CCC[C@H](N)C(O)=O
Canonical SMILES OpenEye OEToolkits 1.5.0 CC(=O)N(CCC[C@@H](C(=O)O)N)O

IUPAC InChI

InChI=1S/C7H14N2O4/c1-5(10)9(13)4-2-3-6(8)7(11)12/h6,13H,2-4,8H2,1H3,(H,11,12)/t6-/m0/s1

IUPAC InChI key

LUZHSHCYVQASCO-LURJTMIESA-N
AHO

wwPDB Information

Atom count

27 (13 without Hydrogen)

Polymer type

Amino Acid

Type description

L-PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

ALA

Defined at

1999-08-13

Last modified at

2021-03-01

Status

Released

Obsoleted

Not Assigned