Details of the Drug Inactive Ingredient (DIG)

General Information of DIG (ID: E0L3OO)
DIG Name
Propylene glycol monolaurate
Synonyms    Click to Show/Hide the Synonyms of This DIG
2-Hydroxypropyl dodecanoate; 2-Hydroxypropyl laurate; 142-55-2; 27194-74-7; Propyleneglycol monolaurate; Lauric acid, monoester with propane-1,2-diol; Dodecanoic acid, monoester with 1,2-propanediol; propylene glycol 1-laurate; Propylene glycol, monolaurate; Emalex PGML; Rikemal PL 100; Lauric acid, 2-hydroxypropyl ester; EINECS 205-542-3; Dodecanoic acid, 2-hydroxypropyl ester; 1,2-Propanediol, 1-laurate; Propylene glycol monododecanoate; Lauroglycol-FCC; Lauroglycol-90; EINECS 248-315-4; Dodecanoic acid,2-hydroxypropyl ester; PG-ML cpd; AI3-00968; Propylene Glycol Monolaur; E 2580; 1,2-Propanediol 1-laurate; SCHEMBL26974; Propylene glycol mono laurate; 1,2-Propanediol, monolaurate; DTXSID30881006; Propylene glycol monolaurate-type I; Propylene glycol monolaurate-type II; 6304AF; AKOS024333016; MCULE-2578838881; Q27283484
DIG Function
Emollient; Emulsifying agent; Oleaginous vehicle; Penetration agent; Solubilizing agent; Surfactant
PubChem CID
14870
Formula
C15H30O3
Canonical SMILES
CCCCCCCCCCCC(=O)OCC(C)O
InChI
1S/C15H30O3/c1-3-4-5-6-7-8-9-10-11-12-15(17)18-13-14(2)16/h14,16H,3-13H2,1-2H3
InChIKey
BHIZVZJETFVJMJ-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=14870"></iframe>
3D MOL 2D MOL
Physicochemical Properties Molecular Weight 258.399 Topological Polar Surface Area 46.5
XlogP 5 Complexity 192
Heavy Atom Count 18 Rotatable Bond Count 13
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3
Full List of Biological Targets of DIG (DBTs) Regulated by This DIG
      Primary active transporter (PAT)
            DBT Name: Multidrug resistance protein 1 (ABCB1) Click to Show/Hide
               Detailed Information DBT Info click to show the detail info of this DBT
               Experiment (1) for Assessing the Biological Activity of the Studied DIG on This DBT
                    Biological Activity Inhibition ratio = 55 % (tested by experiment) [1]
                    Tested Species Homo sapiens (Human)
                    UniProt ID MDR1_HUMAN ; MDR3_HUMAN ; ABCB5_HUMAN
               Experiment (2) for Assessing the Biological Activity of the Studied DIG on This DBT
                    Biological Activity Inhibition ratio = 45 % (tested by experiment) [1]
                    Tested Species Homo sapiens (Human)
                    UniProt ID MDR1_HUMAN ; MDR3_HUMAN ; ABCB5_HUMAN
References
1 Modulation of intestinal P-glycoprotein function by polyethylene glycols and their derivatives by in vitro transport and in situ absorption studies. Int J Pharm. 2006 Apr 26;313(1-2):49-56.

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