bmse000184 Glycerol at BMRB

Glycerol

Trihydroxypropane; Osmoglyn; 1,2,3-Trihydroxypropane; Clyzerin, wasserfrei [German]; Dagralax; Glysanin; 1,2,3-Propanetriol; Vitrosupos; Glycerin mist; Glycerol; Synthetic glycerin

Molecular Formula: C3 H8 O3
Natural Isotopic Abundance Mass: 92.0938200000
Mono-Isotopic Molecular Masses: C12N14: 92.0473441231; C13N14: 95.0574086365; C12N15: 92.0473441231; C13N15: 95.0574086365

Glycerol

InCHi String:
InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2

isomeric and canonical SMILES:
C(C(CO)O)O

IUPAC: IUPAC systematic
propane-1,2,3-triol

IUPAC traditional: IUPAC cas: IUPAC openeye
glycerol

PubChem Substance (SID):   85165005   148790   3416
PubChem Compound (CID):   753
KEGG: Compound ID   C00116
CAS Registry IDs:   29796-42-7   30049-52-6   37228-54-9   56-81-5   75398-78-6   78630-16-7   8013-25-0
PDB Chemical Component   CRY   GOL   ARG   ARG_LFOH   ARG_LFOH_DHH12   ARG_LFOH_DHH22   ARG_LFOH_RNH1   ARG_LFZW   ARG_LFZW_DHH12   ARG_LFZW_DHH22   ARG_LFZW_RNH1   DAR   GND
Miscellaneous Databases and IDs:   CHEBI 17754   FEMA No. 2525   CCRIS 2295   NSC 9230   EINECS 200-289-5   Beilstein Handbook Reference 4-01-00-02751   HSDB 492

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.