General Information of DIG (ID: E0G2XR)
DIG Name
Tristearin
Synonyms    Click to Show/Hide the Synonyms of This DIG
TRISTEARIN; Glycerol tristearate; 555-43-1; Glyceryl tristearate; Stearin; Propane-1,2,3-triyl tristearate; Trioctadecanoin; triacylglycerol; Stearic triglyceride; TRISTEAROYLGLYCEROL; Hardened oil; Stearin, tri-; Spezialfett 118; Stearoyl triglyceride; Dynasan 118; Glycowax S 932; Stearic acid triglycerin ester; Stearic acid triglyceride; Glycerol, trioctadecanoate; Octadecanoic acid, 1,2,3-propanetriyl ester; UNII-P6OCJ2551R; 2,3-di(octadecanoyloxy)propyl octadecanoate; TG(18:0/18:0/18:0); P6OCJ2551R; 1,2,3-trioctadecanoyl-glycerol; 1,2,3-trioctadecanoyl-sn-glycerol; propane-1,2,3-triyl trioctadecanoate; Octadecanoic acid, 1,1',1''-(1,2,3-propanetriyl) ester; HSDB 5690; EINECS 209-097-6; AI3-01633; 1,2,3-Propanetriol trioctadecanoate; Pationic 919; C57H110O6; trioctadecanoylglycerol; 68334-00-9; beta-tristearin (SSS); ACMC-209lnm; Glycerol trioctadecanoate; Cottonseedoil, hydrogenated; Glyceryl tristearate (NF); Glyceryl tristearate-[d9]; EC 209-097-6; SCHEMBL9507; Kemester 6000 (Salt/Mix); Glyceryl tristearate, >=99%; Glyceryl tristearate, technical; DTXSID8047503; CHEBI:45956; Glyceryl tri(octadecanoate-1-13C); 1,2,3-Propanetriyl trioctadecanoate; ANW-32336; LMGL03010002; MFCD00036230; ZINC85545202; AKOS015899779; beta-1,2,3-tri-octadecanoyl-glycerol; GLYCERYL TRIOCTADECANOATE-D110; 2,3-Bis(stearoyloxy)propyl stearate #; GLYCERYL TRI(OCTADECANOATE-D35); AK116949; AS-11714; 1-stearoyl-2-stearoyl-3-stearoyl-glycerol; FT-0675675; G0212; D10637; 29840-EP2275408A1; 29840-EP2284169A1; 29840-EP2287161A1; 29840-EP2287162A1; 29840-EP2289868A1; 29840-EP2311821A1; 29840-EP2311832A1; 29840-EP2311833A1; Q425640; Tristearin, European Pharmacopoeia (EP) Reference Standard; UNII-43AGM4PHPI component DCXXMTOCNZCJGO-UHFFFAOYSA-N; UNII-ZF29F7IK5I component DCXXMTOCNZCJGO-UHFFFAOYSA-N; 125941-88-0; 285979-76-2; 33048-69-0
DIG Function
Emollient; Viscosity-controlling agent
PubChem CID
11146
Formula
C57H110O6
Canonical SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC
InChI
1S/C57H110O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h54H,4-53H2,1-3H3
InChIKey
DCXXMTOCNZCJGO-UHFFFAOYSA-N
   Click to Show/Hide the Molecular Data (Structure/Property) of This DIG
Structure
<iframe style="width: 300px; height: 300px;" frameborder="0" src="https://embed.molview.org/v1/?mode=balls&cid=11146"></iframe>
3D MOL is not available 2D MOL
Physicochemical Properties Molecular Weight 891.5 Topological Polar Surface Area 78.9
XlogP 25.2 Complexity 886
Heavy Atom Count 63 Rotatable Bond Count 56
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 6
Full List of Active Pharmaceutical Ingredients (APIs) Co-administrated with This DIG
       ICD Disease Classification 13 Digestive system disease Click to Show/Hide
Loperamide
API Info
Irritable bowel syndrome [ICD-11: DD91]
[1]
References
1 FDA label for approved loperamide from the official website of the U.S. Food and Drug Administration.

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