Chemical Components in the PDB

pdbe.org/chem
wwPDB
EMDataBank
spacer

DNL : Summary

Code

DNL

One-letter code

K

Molecule name

6-AMINO-HEXANAL

Synonyms

ALPHA-DEAMINO-LYSINAL

Systematic names

ProgramVersionName
ACDLabs 10.04 6-aminohexanal
OpenEye OEToolkits 1.5.0 6-aminohexanal

Formula

C6 H13 N O

Formal charge

0

Molecular weight

115.174 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 O=CCCCCCN
SMILES CACTVS 3.341 NCCCCCC=O
SMILES OpenEye OEToolkits 1.5.0 C(CCC=O)CCN
Canonical SMILES CACTVS 3.341 NCCCCCC=O
Canonical SMILES OpenEye OEToolkits 1.5.0 C(CCC=O)CCN

IUPAC InChI

InChI=1S/C6H13NO/c7-5-3-1-2-4-6-8/h6H,1-5,7H2

IUPAC InChI key

CCYXEHOXJOKCCJ-UHFFFAOYSA-N
DNL

wwPDB Information

Atom count

21 (8 without Hydrogen)

Polymer type

Amino Acid

Type description

L-PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

LYS

Defined at

2001-09-05

Last modified at

2020-06-17

Status

Released

Obsoleted

Not Assigned