General Information of DIG (ID: E0NN1T)
DIG Name
Acetyltributyl citrate
Synonyms    Click to Show/Hide the Synonyms of This DIG
ACETYL TRIBUTYL CITRATE; 77-90-7; tributyl 2-acetoxypropane-1,2,3-tricarboxylate; Tributyl acetylcitrate; Tributyl O-acetylcitrate; Acetyltributyl citrate; Citroflex A; Blo-trol; Citroflex A 4; Tributyl citrate acetate; ATBC; 2-Acetyltributylcitrate; 1,2,3-Propanetricarboxylic acid, 2-(acetyloxy)-, tributyl ester; Tributyl acetyl citrate; acetyltributylcitrate; Acetylcitric acid, tributyl ester; tributyl 2-acetyloxypropane-1,2,3-tricarboxylate; Tributyl acetylicitrate; Citric acid, tributyl ester, acetate; o-Acetylcitric acid tributyl ester; UNII-0ZBX0N59RZ; Acetyl tri-n-butyl citrate; NSC 3894; Uniplex 84; Tributyl 2-acetoxy-1,2,3-propanetricarboxylate; Acetyl butyl citrate; Tributyl 2-(acetyloxy)-1,2,3-propanetricarboxylate; 2-Acetoxy-1,2,3-propanetricarboxylic acid tributyl ester; 0ZBX0N59RZ; 1,2,3-Propanetricarboxylic acid, 2-(acetyloxy)-, 1,2,3-tributyl ester; Citric acid, tributyl ester, acetate (8CI); DSSTox_CID_6446; DSSTox_RID_78115; DSSTox_GSID_26446; Tributyl 2-(acetyloxy)-1,2,3-propanetricarboxylic acid; 1,2,3-Propanetricarboxylic acid, 2-acetoxy-, tributyl ester; Caswell No. 005AB; MFCD00043554; CAS-77-90-7; FEMA No. 3080; CCRIS 3409; HSDB 656; EINECS 201-067-0; Acetyltributyl citrate [NF]; BRN 2303316; Estaflex; AI3-01999; Estaflex ATC; Pfizer citroflex A-4; Acetylcitric acid tributyl; INDIUM(III)SULFATE; EC 201-067-0; SCHEMBL23183; Tributyl O-acetylcitrate, 98%; CHEMBL1904556; DTXSID2026446; Acetyl Tributyl Citrate (ATBC); FEMA 3080; NSC3894; CHEBI:168067; Citric acid, acetyl tributyl ester; 2-(Acetyloxy)-1,2,3-propanetricarboxylic acid, tributyl ester; NSC-3894; ZINC3875493; Tox21_112777; Tox21_201779; Tox21_303128; AKOS015895884; Tributyl 2-acetylcitrate, >=98%, FG; NCGC00164157-01; NCGC00164157-02; NCGC00257221-01; NCGC00259328-01; BS-18149; NCI60_003698; A0822; FT-0621820; Tributyl 2-acetoxy-1,3-propanetricarboxylate; Tributyl 2-acetoxy-1,2, 3-propanetricarboxylate; A839285; SR-01000883988; Q4673294; SR-01000883988-1; Tributyl 2-(acetyloxy)-1,3-propanetricarboxylic acid; 2-Acetoxy-1,3-propanetricarboxylic acid tributyl ester; Tributyl 2-(acetyloxy)-1,2, 3-propanetricarboxylic acid; 1,2,3-tributyl 2-(acetyloxy)propane-1,2,3-tricarboxylate; 2-Acetoxy-1,2, 3-propanetricarboxylic acid tributyl ester; 2-acetyloxypropane-1,2,3-tricarboxylic acid tributyl ester; 1,3-Propanetricarboxylic acid, 2-(acetyloxy)-, tributyl ester; 2-(Acetyloxy)-1,2,3-propane tricarboxylic acid, tributyl ester; 2-ACETYLOXY-1,2,3-PROPANETRICARBOXYLIC ACID TRIBUTYL ESTER; Acetyltributyl citrate, United States Pharmacopeia (USP) Reference Standard; Tributyl acetylcitrate, European Pharmacopoeia (EP) Reference Standard; Tributyl 2-acetylcitrate, Pharmaceutical Secondary Standard; Certified Reference Material
DIG Function
Plasticizing agent
PubChem CID
6505
Formula
C20H34O8
Canonical SMILES
CCCCOC(=O)CC(CC(=O)OCCCC)(C(=O)OCCCC)OC(=O)C
InChI
1S/C20H34O8/c1-5-8-11-25-17(22)14-20(28-16(4)21,19(24)27-13-10-7-3)15-18(23)26-12-9-6-2/h5-15H2,1-4H3
InChIKey
QZCLKYGREBVARF-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=6505"></iframe>
3D MOL is not available 2D MOL
Physicochemical Properties Molecular Weight 402.5 Topological Polar Surface Area 105
XlogP 3.3 Complexity 476
Heavy Atom Count 28 Rotatable Bond Count 19
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 8
Full List of Active Pharmaceutical Ingredients (APIs) Co-administrated with This DIG
       ICD Disease Classification 05 Endocrine/nutritional/metabolic disease Click to Show/Hide
Potassium chloride
API Info
Hypokalemia [ICD-11: 5C77]
[1]
Glipizide
API Info
Diabetes mellitus [ICD-11: 5A10]
[2]
Lovastatin
API Info
Hypertriglyceridaemia [ICD-11: 5C80]
[3]
       ICD Disease Classification 06 Mental/behavioural/neurodevelopmental disorder Click to Show/Hide
Methylphenidate
API Info
Attention deficit hyperactivity disorder [ICD-11: 6A05]
[4]
Dexmethylphenidate
API Info
Attention deficit hyperactivity disorder [ICD-11: 6A05]
[5]
       ICD Disease Classification 11 Circulatory system disease Click to Show/Hide
Diltiazem
API Info
Essential hypertension [ICD-11: BA00]
[6]
Metoprolol
API Info
Essential hypertension [ICD-11: BA00]
[7]
       ICD Disease Classification 12 Respiratory system disease Click to Show/Hide
Budesonide
API Info
Allergic rhinitis [ICD-11: CA08]
[8]
References
1 FDA label for approved potassium chloride from the official website of the U.S. Food and Drug Administration.
2 FDA label for approved glipizide from the official website of the U.S. Food and Drug Administration.
3 FDA label for approved lovastatin from the official website of the U.S. Food and Drug Administration.
4 FDA label for approved methylphenidate from the official website of the U.S. Food and Drug Administration.
5 FDA label for approved dexmethylphenidate from the official website of the U.S. Food and Drug Administration.
6 FDA label for approved diltiazem from the official website of the U.S. Food and Drug Administration.
7 FDA label for approved metoprolol from the official website of the U.S. Food and Drug Administration.
8 FDA label for approved budesonide from the official website of the U.S. Food and Drug Administration.

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