Chemical Components in the PDB

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FHL : Summary

Code

FHL

One-letter code

K

Molecule name

(E)-N~6~-[3-CARBOXY-1-(HYDROXYMETHYL)PROPYLIDENE]-L-LYSINE

Synonyms

2-AMINO-6-(3-CARBOXY-1-HYDROXYMETHYL-PROPYLIDENEAMINO)-HEXANOIC ACID

Systematic names

ProgramVersionName
ACDLabs 10.04 (E)-N~6~-[3-carboxy-1-(hydroxymethyl)propylidene]-L-lysine
OpenEye OEToolkits 1.5.0 (2S)-2-amino-6-[(1,5-dihydroxy-5-oxo-pentan-2-ylidene)amino]hexanoic acid

Formula

C11 H20 N2 O5

Formal charge

0

Molecular weight

260.287 Da

SMILES

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

IUPAC InChI

InChI=1S/C11H20N2O5/c12-9(11(17)18)3-1-2-6-13-8(7-14)4-5-10(15)16/h9,14H,1-7,12H2,(H,15,16)(H,17,18)/b13-8+/t9-/m0/s1

IUPAC InChI key

PTXADOKTUKJDDE-ITTMYVLYSA-N
FHL

wwPDB Information

Atom count

38 (18 without Hydrogen)

Polymer type

Amino Acid

Type description

L-PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

LYS

Defined at

2005-09-11

Last modified at

2023-11-03

Status

Released

Obsoleted

Not Assigned