Details of the Drug Inactive Ingredient (DIG)

General Information of DIG (ID: E0U2IQ)
DIG Name
Stearyl stearate
Synonyms    Click to Show/Hide the Synonyms of This DIG
STEARYL STEARATE; 2778-96-3; Octadecyl Octadecanoate; Octadecyl stearate; Octadecanoic acid, octadecyl ester; Stearic acid stearyl ester; UNII-5WX2EGD0DK; Stearic acid, stearyl ester; octadecanyl octadecanoate; 5WX2EGD0DK; MFCD00056225; Stearyl stearate, 98%; WE(18:0/18:0); Stearic acid, octadecyl ester; Cyclochem SS; Liponate SS; Ritachol SS; Lexol SS; Octadecanoyic acid, octadecyl ester; EINECS 220-476-5; Hetester 412; Emalex CC-18; Loxiol G 30; 1-Octadecyl octadecanoate; Stearyl stearate, ~99%; Stearic acid octadecyl ester; SCHEMBL42773; DTXSID5062639; Octadecanoic acid octadecyl ester; LMFA07010054; Stearyl stearate, analytical standard; ZINC59657416; Stearyl stearate, >=98.0% (GC); AKOS024438267; MCULE-2765770301; FE 78-18; DB-047278; FT-0634483; 778S963; J-016884; Q27262974; UNII-58B69Q84JO component NKBWPOSQERPBFI-UHFFFAOYSA-N; UNII-8Z79DN5I1B component NKBWPOSQERPBFI-UHFFFAOYSA-N; UNII-9T97Q8P3CK component NKBWPOSQERPBFI-UHFFFAOYSA-N; UNII-D072FFP9GU component NKBWPOSQERPBFI-UHFFFAOYSA-N
DIG Function
Emollient; Viscosity-controlling agent
PubChem CID
17720
Formula
C36H72O2
Canonical SMILES
CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCC
InChI
1S/C36H72O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-35H2,1-2H3
InChIKey
NKBWPOSQERPBFI-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=17720"></iframe>
3D MOL is not available 2D MOL
Physicochemical Properties Molecular Weight 537 Topological Polar Surface Area 26.3
XlogP 17.4 Complexity 433
Heavy Atom Count 38 Rotatable Bond Count 34
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2
Full List of Active Pharmaceutical Ingredients (APIs) Co-administrated with This DIG
       ICD Disease Classification 13 Digestive system disease Click to Show/Hide
Simethicone
 API Info
Irritable bowel syndrome [ICD-11: DD91]
 [1]
References
1 FDA label for approved simethicone from the official website of the U.S. Food and Drug Administration.

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