PDB Chemical Component GOL

Ideal Model

Chemical Description

Name GLYCEROL
Synonyms GLYCERIN; PROPANE-1,2,3-TRIOL
Formula C3 H8 O3
Formal charge 0
Molecular weight 92.094 g/mol
Component type NON-POLYMER

Chemical features

Atom count 14
Chiral atom count 0
Bond count 13
Aromatic bond count 0

Chemical Identifiers

Systematic name (ACDLabs) propane-1,2,3-triol
Systematic name (OpenEye OEToolkits) propane-1,2,3-triol

Chemical Descriptors

Stereo SMILES (CACTVS) OCC(O)CO
SMILES (CACTVS) OCC(O)CO
Stereo SMILES (OpenEye) C(C(CO)O)O
InChI descriptor InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2
InChIKey descriptor PEDCQBHIVMGVHV-UHFFFAOYSA-N

Status Information

Last modified 2010-07-30
Created 1999-07-08
Release status REL
Replaces CRY
Model PDB code 1BXO
Processing site EBI