UCSF

ZINC00895048

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2004 6 Yes

Popular Name: Glycerol Glycerol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 12040-65-2 , 139-45-7 , 1401-55-4 , 19622-69-6 , 5459-38-1 , 56-81-5 , 8043-29-6 , [12040-65-2] , [25618-55-7]

Other Names:

1,2,3-Propanetriol

1,2,3-Propanetriol, homopolymer; Glycerol polymer; Glycerol, polymers; HL 80; LS-72131; PGL 300; PGL 500; PGL 700; Polyglycerin; Polyglycerine; Polyglycerol; Unigly G 2; Unigly G 6

1,2,3-Propanetriol, polymer with (chloromethyl)oxirane; Epichlorohydrin-glycerine copolymer; LS-121110

1,2,3-Propanetriol; 1,2,3-Trihydroxypropane; 56-81-5; C00116; Glycerin; Glycerol

1,2,3-Propanetriol; 1,2,3-Trihydroxypropane; 90 Technical glycerine; Aci-Jel; Auralgan; Citifluor AF 2; Clyzerin, wasserfrei [German]; Collyrium Fresh-Eye Drops; Dagralax; Glicerina [DCIT]; Glicerol [INN-Spanish]; Glycerin; Glycerin (mist); Glycerin mist

1,2,3-Propanetriol; 1,2,3-Trihydroxypropane; 90 Technical glycerine; AI3-00091; Aci-Jel; Auralgan; BRN 0635685; Caswell No. 469; Citifluor AF 2; Clyzerin, wasserfrei [German]; Collyrium Fresh-Eye Drops; Dagralax; EPA Pesticide Chemical Code 063507; Glicer

1,2,3-Propanetriol; 1,2,3-Trihydroxypropane; 90 Technical glycerine; AI3-00091; Auralgan; BRN 0635685; CCRIS 2295; Caswell No. 469; Citifluor AF 2; Clyzerin, wasserfrei [German]; Collyrium Fresh-Eye Drops; Dagralax; EINECS 200-289-5; EPA Pesticide Chemica

1,2,3-trihydroxypropane; 1,2,3-trihydroxypropanol; 56-81-5; glycerin; glycerol

1,2,3-Trihydroxypropane; Bulbold; Cristal; E 422; Emery 916; Glyceol Opthalgan; Glycerin; Glycerine; Glyceritol; Glycerol; Glycyl alcohol; Glyrol; Glysanin; IFP; Incorporation factor; Mackstat H 66; Osmoglyn; Pricerine 9091; Propanetriol; RG-S; Trihydroxy

1,2,3-Trihydroxypropane; Bulbold; Cristal; Glyceol Opthalgan; Glycerin; Glycerine; Glyceritol; Glycerol; Glycyl alcohol; Glyrol; Glysanin; IFP; Incorporation factor; Osmoglyn; Propanetriol; RG-S; Trihydroxypropane; Tryhydroxypropane

1,2,3-Trihydroxypropane;Bulbold;Cristal;E 422;Emery 916;Glyceol Opthalgan;Glycerin;Glycerine;Glyceritol;Glycerol;Glycyl alcohol;Glyrol;Glysanin;IFP;Incorporation factor;Mackstat H 66;Osmoglyn;Pricerine 9091;Propanetriol;RG-S;Trihydroxypropane;Tryhydroxypr

56-81-5; Concentrated glycerin (JP16); D00028; Glycerin (JP16/USP); Glycerin, concentrated (JAN); Glycerol (INN)

alditol

CHEBI:131422; CHEBI:42998; CHEBI:5448; CHEBI:14334; CHEBI:24351

CHEBI:2556; CHEBI:13754; CHEBI:22298

D05073; Moctanin (TN); Monoctanoin (USAN)

Glycerin

Glycerin (FDA

Glycerite

Glyceritol; Glyzerin; Gro; Oelsuess; Propanetriol; Trihydroxypropane; glycerine; glycerol; glycyl alcohol

Glycerol Tripropionate

Glycerol [for Electrophoresis]

Glycerol [Matrix for FABMS and liquid SIMS]

Glycerol, 99+%

Glycerol, 99+%, extra pure

Glycerol, 99+%, pure, synthetic

Glycerol, 99.5%, for molecular biology, DNAse, RNAse and Protease free

Glycerol, 99.5+%, for spectroscopy

Glycerol, 99.6%, ACS reagent

Glycerol, ACS

Glycerol, ACS, 99.5+%

Glycerol, for analysis, 86-88% wt% aqueous solution

Glycerol, pure, 83.5-88.5 wt% aqueous solution

Glycerol, ultrapure, HPLC Grade

Glycerol, ultrapure, Spectrophotometric Grade

GLYCEROL, [1,3-14C]

GLYCEROL,[1,3-14C]

glycerol; glycerolum

glyceroltriacrylate

GlycerolTripropionate

Glycerophosphoric acid

JAN

LS-3195; Synthetic glycerin; glycerin, synthetic

MFCD00004722

MFCD01772705

Polyglycerine

Polyglycerine, Tech.

Polyglycerine, Technical grade

USP); Glycerol (INN)

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -1.60 -6.46 -8.71 3 3 0 61 92.094 2 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.17e+03 g/l DrugBank-experimental
Mp [°C] 18 Acros Organics
Boiling_Point 182?/20mm Alfa-Aesar
Boiling_Point 182°/20mm Alfa-Aesar
Melting_Point 18? Alfa-Aesar
Melting_Point 18° Alfa-Aesar
BP [°C] 290 Acros Organics
Purity 99% Fluorochem
UniProt Database Links A1A1A_DANRE; A1A1B_DANRE; A85C_MYCTU; AAPT1_ARATH; AAPT2_ARATH; ABD12_BOVIN; ABD12_CHICK; ABD12_DANRE; ABD12_HUMAN; ABD12_MACFA; ABD12_MOUSE; ABD12_RAT; ABD12_XENTR; ABFB_EMENI; ABH6A_XENLA; ABH6B_XENLA; ABHD5_HUMAN; ABHD5_MOUSE; ABHD5_PIG; ABHD5_PONAB; A ChEBI
UniProt Database Links ALD1_MOUSE; ALD1_RAT; ALD2_CRIGR; ALD2_MOUSE; ALDR_BOVIN; ALDR_ENCCU; ALDR_HORVU; ALDR_HUMAN; ALDR_MOUSE; ALDR_PIG; ALDR_RABIT; ALDR_RAT; ALRA_DICDI; ALRB_DICDI; ALRC_DICDI; GRE3_YEAST ChEBI
Patent Database Links EP0789023; EP0815857; EP0856515; EP0962459; EP0965583; EP0965584; EP0967214; EP0978281; EP1120119; EP1123935; EP1151994; EP1156042; EP1170295; EP1225172; EP1252893; EP1254659; EP1266664; EP1266951; EP1314424; EP1318200; EP1354587; EP1391473; EP1422213; EP ChEBI
Patent Database Links EP1468989; EP1555033; EP1576894; EP1618876; EP1661562; EP1749516; EP1759713; EP1923060; US2002016300; US2002156022; US2002169344; US2003125588; US2003232877; US2003236298; US2004048858; US2004082807; US2004138147; US2005065139; US2005171028; US2006063828 ChEBI
Reactome Database Links REACT_120753; REACT_120776; REACT_121144; REACT_121402; REACT_19155; REACT_23780; REACT_23873; REACT_23921; REACT_23966; REACT_594; REACT_724; REACT_9502 ChEBI
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
PUBCHEM_PATENT_ID WO2000074681A1 IBM Patent Data

Activity (Go SEA)

Direct Reactome Annotations (via ChEBI)

Description Species
Acyl chain remodeling of DAG and TAG
Arachidonate production from DAG
Digestion of dietary lipid
Hormone-sensitive lipase (HSL)-mediated triacylglycerol hydrolysis
Passive transport by Aquaporins
Synthesis of PG
Transport of glycerol from adipocytes to the liver by Aquaporins
Triglyceride Biosynthesis

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.