Chemical Components in the PDB

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F7V : Summary

Code

F7V

One-letter code

X

Molecule name

(2S,4E)-2-aminohex-4-enoic acid

Systematic names

ProgramVersionName
ACDLabs 12.01 (2S,4E)-2-aminohex-4-enoic acid
OpenEye OEToolkits 2.0.6 (~{E},2~{S})-2-azanylhex-4-enoic acid

Formula

C6 H11 N O2

Formal charge

0

Molecular weight

129.157 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 12.01 NC(C(O)=O)C\C=C\C
SMILES CACTVS 3.385 CC=CC[CH](N)C(O)=O
SMILES OpenEye OEToolkits 2.0.6 CC=CCC(C(=O)O)N
Canonical SMILES CACTVS 3.385 C/C=C/C[C@H](N)C(O)=O
Canonical SMILES OpenEye OEToolkits 2.0.6 C/C=C/C[C@@H](C(=O)O)N

IUPAC InChI

InChI=1S/C6H11NO2/c1-2-3-4-5(7)6(8)9/h2-3,5H,4,7H2,1H3,(H,8,9)/b3-2+/t5-/m0/s1

IUPAC InChI key

OPOBBDXDRHKTJF-HRJJCQLASA-N
F7V

wwPDB Information

Atom count

20 (9 without Hydrogen)

Polymer type

Amino Acid

Type description

L-peptide linking

Type code

ATOMP

Is modified

No

Standard parent

Not Assigned

Defined at

2018-03-09

Last modified at

2019-05-30

Status

Released

Obsoleted

Not Assigned