Chemical Components in the PDB

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ACM : Summary

Code

ACM

One-letter code

X

Molecule name

ACETAMIDE

Systematic names

ProgramVersionName
ACDLabs 10.04 acetamide
OpenEye OEToolkits 1.5.0 ethanamide

Formula

C2 H5 N O

Formal charge

0

Molecular weight

59.067 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 O=C(N)C
SMILES CACTVS 3.341 CC(N)=O
SMILES OpenEye OEToolkits 1.5.0 CC(=O)N
Canonical SMILES CACTVS 3.341 CC(N)=O
Canonical SMILES OpenEye OEToolkits 1.5.0 CC(=O)N

IUPAC InChI

InChI=1S/C2H5NO/c1-2(3)4/h1H3,(H2,3,4)

IUPAC InChI key

DLFVBJFMPXGRIB-UHFFFAOYSA-N
ACM

wwPDB Information

Atom count

9 (4 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

1999-07-08

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned