Details of the Drug Inactive Ingredient (DIG)

General Information of DIG (ID: E0CT8R)
DIG Name
Sodium oleate
Synonyms    Click to Show/Hide the Synonyms of This DIG
SODIUM OLEATE; 143-19-1; Oleic acid sodium salt; Oleic acid, sodium salt; UNII-399SL044HN; Osteum; sodium;(Z)-octadec-9-enoate; 16558-02-4; CHEBI:81860; 399SL044HN; cis-9-Octadecenoic acid sodium salt; MFCD00004438; Eunatrol; Olate flakes; Sodiumoleate; Oleate, sodium; sodium (Z)-octadec-9-enoate; 9-Octadecenoic acid (Z)-, sodium salt; CCRIS 1964; HSDB 758; Sodium 9-octadecenoate, (Z)-; Sodium 9-octadecenoate; EINECS 205-591-0; 9-Octadecenoic acid (9Z)-, sodium salt; 9-Octadecenoic acid, sodium salt, (Z)-; AI3-19806; sodium (9Z)-octadec-9-enoate; Oleic acid sodium; 9-Octadecenoic acid, sodium salt; Sodium oleate powder; Oleic acidsodium salt; 9-Octadecenoic acid (9Z)-, sodium salt (1:1); Sodium oleate, >=99%; SCHEMBL3582; C18H33O2.Na; CHEMBL3527599; DTXSID7021077; Sodium oleate, >=98.5% (GC); 6476AF; AKOS017345104; Sodium oleate, >=95% (capillary GC); AS-10421; O0057; C18601; Oleic acid, sodium salt, 65-90% oleic C18; Q17397737; UNII-07RIK6QMEW component BCKXLBQYZLBQEK-KVVVOXFISA-M; UNII-0B312121CX component BCKXLBQYZLBQEK-KVVVOXFISA-M; UNII-6H91L1NXTW component BCKXLBQYZLBQEK-KVVVOXFISA-M; UNII-6NAB04XUFO component BCKXLBQYZLBQEK-KVVVOXFISA-M; UNII-S0A6004K3Z component BCKXLBQYZLBQEK-KVVVOXFISA-M; Sodium oleate, >=82% fatty acids (as oleic acid) basis, powder
DIG Function
Complexing agent; Emulsifying agent; Surfactant; Viscosity-controlling agent
PubChem CID
23665730
Formula
C18H33NaO2
Canonical SMILES
CCCCCCCC/C=C\\CCCCCCCC(=O)[O-].[Na+]
InChI
1S/C18H34O2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h9-10H,2-8,11-17H2,1H3,(H,19,20);/q;+1/p-1/b10-9-;
InChIKey
BCKXLBQYZLBQEK-KVVVOXFISA-M
   Click to Show/Hide the Molecular Data (Structure/Property) of This DIG
Structure
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3D MOL is not available 2D MOL
Physicochemical Properties Molecular Weight 304.4 Topological Polar Surface Area 40.1
XlogP N.A. Complexity 239
Heavy Atom Count 21 Rotatable Bond Count 15
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2
Full List of Biological Targets of DIG (DBTs) Regulated by This DIG
      Lyase/isomerase/ligase (L/I/G)
            DBT Name: Cholesterol 25-hydroxylase (CYP1A2) Click to Show/Hide
               Detailed Information DBT Info click to show the detail info of this DBT
               Experiment for Assessing the Biological Activity of the Studied DIG on This DBT
                    Biological Activity Ki = 16700 nM (tested by experiment) [1]
                    Tested Species Rattus norvegicus (Rat)
                    UniProt ID CP1A2_RAT
References
1 Effect of albumin on human liver microsomal and recombinant CYP1A2 activities: impact on in vitro-in vivo extrapolation of drug clearance. Drug Metab Dispos. 2012 May; 40(5):982-9.

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