Details of the Drug Inactive Ingredient (DIG)

General Information of DIG (ID: E0JP9O)
DIG Name
Caprylic acid
Synonyms    Click to Show/Hide the Synonyms of This DIG
octanoic acid; caprylic acid; 124-07-2; n-octanoic acid; Octylic acid; n-caprylic acid; octoic acid; n-octylic acid; n-Octoic acid; neo-fat 8; 1-heptanecarboxylic acid; Enantic acid; Octic acid; C-8 acid; Kaprylsaeure; Hexacid 898; Acido octanoico; Acide octanoique; 1-octanoic acid; Acidum octanocium; Fatty acids, C6-10; FEMA No. 2799; Kyselina kaprylova; capryloate; C8:0; octylate; Octansaeure; NSC 5024; UNII-OBL58JN025; MFCD00004429; OCTANOIC ACID (CAPRYLIC ACID); CHEBI:28837; Emery 657; Prifac 2901; Lunac 8-95; NSC-5024; CH3-[CH2]6-COOH; OBL58JN025; Caprylsaeure; NSC5024; caprilate; EDENOR C 8-98-100; Caprylic acid, potassium salt; n-caprylate; n-octoate; n-octylate; Octanoic acid, 99%; NCGC00090957-01; 0ctanoic acid; 1-heptanecarboxylate; DSSTox_CID_1645; Octanoic acid-8-13C; DSSTox_RID_76259; DSSTox_GSID_21645; OCA; Octanoic-8,8,8-D3 acid; Caprylic acid (natural); Acide octanoique [French]; Acido octanoico [Spanish]; Acidum octanocium [Latin]; Kyselina kaprylova [Czech]; Octanoic acid [USAN:INN]; CAS-124-07-2; CCRIS 4689; HSDB 821; CH3-[CH2]6-COO(-); caprylic acid, tin salt; caprylic acid, zinc salt; EINECS 204-677-5; caprylic acid, barium salt; caprylic acid, cesium salt; caprylic acid, cobalt salt; caprylic acid, copper salt; caprylic acid, sodium salt; caprylic acid, ammonia salt; caprylic acid, cadmium salt; caprylic acid, calcium salt; BRN 1747180; caprylic acid, 14C-labeled; caprylic acid, aluminum salt; caprylic acid, manganese salt; caprylic acid, zirconium salt; caprylic-acid; octanic acid; Caprilic acid; caprylic acid, tin(+2) salt; AI3-04162; caprylic acid, iron(+3) salt; caprylic acid, lead(+2) salt; acidum octanoicum; octanoate radical; caprylic acid, copper(+2) salt; caprylic acid, iridum(+3) salt; caprylic acid, nickel(+2) salt; caprylic acid, chromium(+2) salt; caprylic acid, lanthanum(+3) salt; caprylic acid, ruthenium(+3) salt; caprylic acid, zirconium(+4) salt; EINECS 273-085-7; Acid C8; Octanoic acid radical; Caprylic acid (NF); Kortacid 0899; Neo-Fat 8S; Caprylic Acid 657; 156779-05-4; 202114-57-6; 287111-06-2; 287111-08-4; 287111-09-5; 64118-36-1; Octanoate, ion(1-); caprylic acid, sodium salt, 11C-labeled; n-heptanecarboxylic acid; Octanoic acid (USAN); Fatty acids, C6-1O; ACMC-1BTHQ; Lunac 8-98; Octanoic-2,2-D2 acid; Heptane-1-carboxylic acid; Octanoic acid, >=98%; Octanoic acid, >=99%; bmse000502; Caprylic/Capric Acid Blend; CCCCCCCC([O])=O; EC 204-677-5; Octanoic acid-2-[13C]; SCHEMBL3933; WLN: QV7; NCIOpen2_002902; NCIOpen2_009358; Octanoic acid (USAN/INN); Octanoic-d15 acid (9CI); 4-02-00-00982 (Beilstein Handbook Reference); 68937-74-6; MLS002415762; Octanoic acid, >=96.0%; caprylic acid (octanoic acid); Octanoic acid (mixed isomers); CHEMBL324846; GTPL4585; Octanoic acid, >=98%, FG; QSPL 011; QSPL 184; DTXSID3021645; Octanoic acid-1,2-[13C2]; Octanoic acid-7,8-[13C2]; HMS2270A23; Octanoic acid, analytical standard; STR10050; ZINC1530416; Tox21_111045; Tox21_201279; Tox21_300345; ANW-18188; BDBM50485608; LMFA01010008; s6296; SBB060020; STL282742; AKOS000118802; Octanoic acid, natural, >=98%, FG; DB04519; FA(8:0); MCULE-5193957469; NE10316; Octanoic acid, for synthesis, 99.5%; NCGC00090957-02; NCGC00090957-03; NCGC00090957-04; NCGC00090957-05; NCGC00254446-01; NCGC00258831-01; HY-41417; M789; SMR001252279; 597-EP2269988A2; 597-EP2270008A1; 597-EP2275413A1; 597-EP2287156A1; 597-EP2292617A1; 597-EP2298780A1; 597-EP2301940A1; 597-EP2305689A1; 597-EP2311807A1; 597-EP2311824A1; 597-EP2374787A1; AK00487762; CS-0016549; FT-0660765; O0027; ST51046283; C06423; D05220; 146488-EP2280007A1; 146488-EP2292597A1; Q409564; SR-01000865607; J-005040; SR-01000865607-2; BRD-K35170555-001-07-9; Z955123584; Octanoic acid, certified reference material, TraceCERT(R); UNII-13FB83DEYU component WWZKQHOCKIZLMA-UHFFFAOYSA-N; UNII-DI775RT244 component WWZKQHOCKIZLMA-UHFFFAOYSA-N; 43FDA9D7-2300-41E7-A373-A34F25B81553; Caprylic acid, European Pharmacopoeia (EP) Reference Standard; UNII-79P21R4317 component WWZKQHOCKIZLMA-UHFFFAOYSA-N; Caprylic acid, United States Pharmacopeia (USP) Reference Standard; Caprylic Acid (Octanoic Acid), Pharmaceutical Secondary Standard; Certified Reference Material
DIG Function
Emulsifying agent; Flavoring agent; Surfactant
PubChem CID
379
Formula
C8H16O2
Canonical SMILES
CCCCCCCC(=O)O
InChI
1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)
InChIKey
WWZKQHOCKIZLMA-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=379"></iframe>
3D MOL 2D MOL
Physicochemical Properties Molecular Weight 144.21 Topological Polar Surface Area 37.3
XlogP 3 Complexity 89.3
Heavy Atom Count 10 Rotatable Bond Count 6
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2
Full List of Active Pharmaceutical Ingredients (APIs) Co-administrated with This DIG
       ICD Disease Classification 01 Infectious/parasitic disease Click to Show/Hide
Azithromycin
 API Info
Congenital syphilis [ICD-11: 1A60]
 [1]
       ICD Disease Classification 06 Mental/behavioural/neurodevelopmental disorder Click to Show/Hide
Lamotrigine
 API Info
Bipolar disorder [ICD-11: 6A60]
 [2]
       ICD Disease Classification 08 Nervous system disease Click to Show/Hide
Ropinirole
 API Info
Parkinsonism [ICD-11: 8A00]
 [3]
Hydrocodone
 API Info
Anaesthesia [ICD-11: 8E22]
 [4]
Ezogabine
 API Info
Epilepsy [ICD-11: 8A60]
 [5]
       ICD Disease Classification 11 Circulatory system disease Click to Show/Hide
Clopidogrel
 API Info
Deep vein thrombosis [ICD-11: BD71]
 [6]
       ICD Disease Classification 12 Respiratory system disease Click to Show/Hide
Loratadine
 API Info
Allergic rhinitis [ICD-11: CA08]
 [7]
       ICD Disease Classification 15 Musculoskeletal/connective-tissue disease Click to Show/Hide
Cyclosporin A
 API Info
Rheumatoid arthritis [ICD-11: FA20]
 [8]
       ICD Disease Classification 16 Genitourinary system disease Click to Show/Hide
Dutasteride
 API Info
Prostatic hyperplasia [ICD-11: GA90]
 [9]
Full List of Biological Targets of DIG (DBTs) Regulated by This DIG
      G-protein coupled receptor (GPCR)
            DBT Name: GPCR84 receptor (GPR84) 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 = 19600 nM (tested by experiment) [10]
                    Tested Species Homo sapiens (Human)
                    UniProt ID GPR84_HUMAN
References
1 FDA label for approved azithromycin from the official website of the U.S. Food and Drug Administration.
2 FDA label for approved lamotrigine from the official website of the U.S. Food and Drug Administration.
3 FDA label for approved ropinirole from the official website of the U.S. Food and Drug Administration.
4 FDA label for approved hydrocodone from the official website of the U.S. Food and Drug Administration.
5 FDA label for approved ezogabine from the official website of the U.S. Food and Drug Administration.
6 FDA label for approved clopidogrel from the official website of the U.S. Food and Drug Administration.
7 FDA label for approved loratadine from the official website of the U.S. Food and Drug Administration.
8 FDA label for approved cyclosporin A from the official website of the U.S. Food and Drug Administration.
9 FDA label for approved dutasteride from the official website of the U.S. Food and Drug Administration.
10 An Agonist Radioligand for the Proinflammatory Lipid-Activated G Protein-Coupled Receptor GPR84 Providing Structural Insights. J Med Chem. 2020 Mar 12; 63(5):2391-2410.

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