Details of the Drug Inactive Ingredient (DIG)

General Information of DIG (ID: E06RUT)
DIG Name	D&C red no. 27
Synonyms	Click to Show/Hide the Synonyms of This DIG 13473-26-2; D & C Red no. 27; Phloxine O; Acid Phloxine PB; Phloxine BBN Supra; Japan Red 218; Solvent Red 48; D&C Red No. 27; D&C red no.27; C.I. Solvent Red 48; C.I. 45410A; D and C Red No. 27; D&C Red 27; Red No. 218; Phloxine B (free base); UNII-2LRS185U6K; 2',4',5',7'-Tetrabromo-3,4,5,6-tetrachlorofluorescein; 2LRS185U6K; CI 45410:1; 2',4',5',7'-tetrabromo-4,5,6,7-tetrachlorofluorescein; DSSTox_CID_11089; DSSTox_RID_78862; DSSTox_GSID_31089; Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxy-; 2,4,5,7-TETRABROMO-3,4,5,6-TETRACHLOROFLUORESCEIN; C,I, Solvent Red 48; 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxy-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one; 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxy-3H-spiro[isobenzofuran-1,9'-xanthen]-3-one; Spiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one, 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxy-; CAS-13473-26-2; CCRIS 4905; EINECS 236-747-6; CI Solvent Red 48; D&C Red Dye 27; SCHEMBL111115; CHEMBL1580759; DTXSID2031089; CHEBI:156496; ZINC8830543; Tox21_202165; Tox21_303604; MFCD00067282; NCGC00091490-01; NCGC00091490-02; NCGC00091490-03; NCGC00257462-01; NCGC00259714-01; 2',4',5',7'-Tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxyspiro(i- sobenzofuran-1(3H), 9'-(9H)xanthen)-3-one; 2',4',5',7'-Tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxyspiro(isobenzofuran-1(3H),9'-(9H)xanthene)-3-one; 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one; C.I. 45410:1; Q27254902; 2',4',5',7'-tetrabromo-3,4,5,6-tetrachlorofluorescein, AldrichCPR; 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxy-3H-spiro[[2]benzofuran-1,9'-xanthen]-3-one; 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxyspiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one
DIG Function	Colorant
PubChem CID	83511
Formula	C20H4Br4Cl4O5
Canonical SMILES	C1=C2C(=C(C(=C1Br)O)Br)OC3=C(C(=C(C=C3C24C5=C(C(=C(C(=C5Cl)Cl)Cl)Cl)C(=O)O4)Br)O)Br
InChI	1S/C20H4Br4Cl4O5/c21-5-1-3-17(9(23)15(5)29)32-18-4(2-6(22)16(30)10(18)24)20(3)8-7(19(31)33-20)11(25)13(27)14(28)12(8)26/h1-2,29-30H
InChIKey	ZYIBVBKZZZDFOY-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=83511"></iframe>
Structure	3D MOL		2D MOL
Physicochemical Properties	Molecular Weight	785.7	Topological Polar Surface Area	76
	XlogP	8.7	Complexity	780
	Heavy Atom Count	33	Rotatable Bond Count	0
	Hydrogen Bond Donor Count	2	Hydrogen Bond Acceptor Count	5

Full List of Active Pharmaceutical Ingredients (APIs) Co-administrated with This DIG
ICD Disease Classification 01		Infectious/parasitic disease	Click to Show/Hide
Minocycline	API Info	Streptococcus bacterial infection [ICD-11: 1C41]		[1]
Chloroquine	API Info	Malaria [ICD-11: 1F40]		[2]
ICD Disease Classification 02		Benign/in-situ/malignant neoplasm	Click to Show/Hide
Letrozole	API Info	Breast cancer [ICD-11: 2C60]		[3]
ICD Disease Classification 05		Endocrine/nutritional/metabolic disease	Click to Show/Hide
Levothroid	API Info	Hypothyroidism [ICD-11: 5A00]		[4]
Glimepiride	API Info	Diabetes mellitus [ICD-11: 5A10]		[5]
Glyburide	API Info	Diabetes mellitus [ICD-11: 5A10]		[6]
ICD Disease Classification 06		Mental/behavioural/neurodevelopmental disorder	Click to Show/Hide
Bupropion	API Info	Nicotine dependence [ICD-11: 6C4A]		[7]
Amitriptyline	API Info	Major depressive disorder [ICD-11: 6A70]		[8]
Desipramine	API Info	Attention deficit hyperactivity disorder [ICD-11: 6A05]		[9]
Haloperidol	API Info	Schizophrenia [ICD-11: 6A20]		[10]
Fluphenazine	API Info	Schizophrenia [ICD-11: 6A20]		[11]
Isocarboxazid	API Info	Major depressive disorder [ICD-11: 6A70]		[12]
ICD Disease Classification 07		Sleep-wake disorder	Click to Show/Hide
Dextroamphetamine	API Info	Narcolepsy [ICD-11: 7A20]		[13]
ICD Disease Classification 08		Nervous system disease	Click to Show/Hide
Acetaminophen	API Info	Anaesthesia [ICD-11: 8E22]		[14]
Morphine	API Info	Anaesthesia [ICD-11: 8E22]		[15]
Oxycodone	API Info	Anaesthesia [ICD-11: 8E22]		[16]
Valproic acid	API Info	Epilepsy [ICD-11: 8A60]		[17]
Pramipexole	API Info	Parkinsonism [ICD-11: 8A00]		[18]
Ropinirole	API Info	Parkinsonism [ICD-11: 8A00]		[19]
Levetiracetam	API Info	Focal seizure [ICD-11: 8A68]		[20]
Oxymorphone	API Info	Anaesthesia [ICD-11: 8E22]		[21]
Galantamine	API Info	Alzheimer disease [ICD-11: 8A20]		[22]
Meperidine	API Info	Anaesthesia [ICD-11: 8E22]		[23]
Sumatriptan	API Info	Migraine [ICD-11: 8A80]		[24]
Benzocaine	API Info	Anaesthesia [ICD-11: 8E22]		[25]
ICD Disease Classification 10		Ear/mastoid process disease	Click to Show/Hide
Diphenhydramine	API Info	Meniere disease [ICD-11: AB31]		[26]
ICD Disease Classification 11		Circulatory system disease	Click to Show/Hide
Aspirin	API Info	Myocardial infarction [ICD-11: BA41]		[27]
Metoprolol	API Info	Essential hypertension [ICD-11: BA00]		[28]
Enalapril	API Info	Essential hypertension [ICD-11: BA00]		[29]
Caffeine	API Info	Orthostatic hypotension [ICD-11: BA21]		[30]
Nifedipine	API Info	Angina pectoris [ICD-11: BA40]		[31]
Isosorbide mononitrate	API Info	Angina pectoris [ICD-11: BA40]		[32]
Nebivolol	API Info	Pulmonary hypertension [ICD-11: BB01]		[33]
ICD Disease Classification 12		Respiratory system disease	Click to Show/Hide
Promethazine	API Info	Allergic rhinitis [ICD-11: CA08]		[34]
Loratadine	API Info	Allergic rhinitis [ICD-11: CA08]		[35]
Cefditoren pivoxil	API Info	Pneumocystis pneumonia [ICD-11: CA40]		[36]
ICD Disease Classification 13		Digestive system disease	Click to Show/Hide
Bisacodyl	API Info	Irritable bowel syndrome [ICD-11: DD91]		[37]
Simethicone	API Info	Irritable bowel syndrome [ICD-11: DD91]		[38]
Esomeprazole	API Info	Duodenal ulcer [ICD-11: DA63]		[39]
Bismuth subsalicylate	API Info	Irritable bowel syndrome [ICD-11: DD91]		[40]
Sodium fluoride	API Info	Periodontal disease [ICD-11: DA0C]		[41]
ICD Disease Classification 14		Skin disease	Click to Show/Hide
Pseudoephedrine	API Info	Erythema multiforme [ICD-11: EB12]		[42]
Isotretinoin	API Info	Acne vulgaris [ICD-11: ED80]		[43]
Demeclocycline	API Info	Acne vulgaris [ICD-11: ED80]		[44]
ICD Disease Classification 15		Musculoskeletal/connective-tissue disease	Click to Show/Hide
Diclofenac	API Info	Knee osteoarthritis [ICD-11: FA01]		[45]
Phenylephrine	API Info	Juvenile rheumatoid arthritis [ICD-11: FA24]		[46]
ICD Disease Classification 16		Genitourinary system disease	Click to Show/Hide
Ibuprofen	API Info	Dysmenorrhea [ICD-11: GA34]		[47]
Oxybutynin	API Info	Overactive bladder [ICD-11: GC50]		[48]
ICD Disease Classification 20		Developmental anomaly	Click to Show/Hide
Estradiol	API Info	Turner syndrome [ICD-11: LD50]		[49]

Full List of Biological Targets of DIG (DBTs) Regulated by This DIG
Transferase (TFase)
DBT Name: Arginine methyltransferase 1 (PRMT1)		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	IC50 = 1400 nM (estimated based on the structural similarity with CHEMBL376503 )		[50]
Structural Similarity	Tanimoto coefficient = 0.781914894
Tested Species	Homo sapiens (Human)
UniProt ID	ANM1_HUMAN
Potential-driven transporter (PDT)
DBT Name: Solute carrier SLCO2B1 (OATPB)		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 = 69 % (tested by experiment)		[51]
Tested Species	Homo sapiens (Human)
UniProt ID	SO2B1_HUMAN
Experiment (2) for Assessing the Biological Activity of the Studied DIG on This DBT
Biological Activity	Ki = 1 uM (tested by experiment)		[51]
Tested Species	Homo sapiens (Human)
UniProt ID	SO2B1_HUMAN

References
1	FDA label for approved minocycline from the official website of the U.S. Food and Drug Administration.
2	FDA label for approved chloroquine from the official website of the U.S. Food and Drug Administration.
3	FDA label for approved letrozole from the official website of the U.S. Food and Drug Administration.
4	FDA label for approved levothroid from the official website of the U.S. Food and Drug Administration.
5	FDA label for approved glimepiride from the official website of the U.S. Food and Drug Administration.
6	FDA label for approved glyburide from the official website of the U.S. Food and Drug Administration.
7	FDA label for approved bupropion from the official website of the U.S. Food and Drug Administration.
8	FDA label for approved amitriptyline from the official website of the U.S. Food and Drug Administration.
9	FDA label for approved desipramine from the official website of the U.S. Food and Drug Administration.
10	FDA label for approved haloperidol from the official website of the U.S. Food and Drug Administration.
11	FDA label for approved fluphenazine from the official website of the U.S. Food and Drug Administration.
12	FDA label for approved isocarboxazid from the official website of the U.S. Food and Drug Administration.
13	FDA label for approved dextroamphetamine from the official website of the U.S. Food and Drug Administration.
14	FDA label for approved acetaminophen from the official website of the U.S. Food and Drug Administration.
15	FDA label for approved morphine from the official website of the U.S. Food and Drug Administration.
16	Efficacy of oxycodone in neuropathic pain: a randomized trial in postherpetic neuralgia. Neurology. 1998 Jun;50(6):1837-41.
17	FDA label for approved valproic acid from the official website of the U.S. Food and Drug Administration.
18	FDA label for approved pramipexole from the official website of the U.S. Food and Drug Administration.
19	FDA label for approved ropinirole from the official website of the U.S. Food and Drug Administration.
20	FDA label for approved levetiracetam from the official website of the U.S. Food and Drug Administration.
21	FDA label for approved oxymorphone from the official website of the U.S. Food and Drug Administration.
22	FDA label for approved galantamine from the official website of the U.S. Food and Drug Administration.
23	FDA label for approved meperidine from the official website of the U.S. Food and Drug Administration.
24	FDA label for approved sumatriptan from the official website of the U.S. Food and Drug Administration.
25	Benzocaine.
26	FDA label for approved diphenhydramine from the official website of the U.S. Food and Drug Administration.
27	FDA label for approved aspirin from the official website of the U.S. Food and Drug Administration.
28	FDA label for approved metoprolol from the official website of the U.S. Food and Drug Administration.
29	FDA label for approved enalapril from the official website of the U.S. Food and Drug Administration.
30	FDA label for approved caffeine from the official website of the U.S. Food and Drug Administration.
31	FDA label for approved nifedipine from the official website of the U.S. Food and Drug Administration.
32	FDA label for approved isosorbide mononitrate from the official website of the U.S. Food and Drug Administration.
33	FDA label for approved nebivolol from the official website of the U.S. Food and Drug Administration.
34	FDA label for approved promethazine from the official website of the U.S. Food and Drug Administration.
35	FDA label for approved loratadine from the official website of the U.S. Food and Drug Administration.
36	FDA label for approved cefditoren pivoxil from the official website of the U.S. Food and Drug Administration.
37	FDA label for approved bisacodyl from the official website of the U.S. Food and Drug Administration.
38	FDA label for approved simethicone from the official website of the U.S. Food and Drug Administration.
39	FDA label for approved esomeprazole from the official website of the U.S. Food and Drug Administration.
40	Bismuth Subsalicylate.
41	FDA label for approved sodium fluoride from the official website of the U.S. Food and Drug Administration.
42	A study of sustained action pseudoephedrine in allergic rhinitis. Ann Allergy. 1982 Feb;48(2):87-92.
43	FDA label for approved isotretinoin from the official website of the U.S. Food and Drug Administration.
44	FDA label for approved demeclocycline from the official website of the U.S. Food and Drug Administration.
45	FDA label for approved diclofenac from the official website of the U.S. Food and Drug Administration.
46	FDA label for approved phenylephrine from the official website of the U.S. Food and Drug Administration.
47	FDA label for approved ibuprofen from the official website of the U.S. Food and Drug Administration.
48	FDA label for approved oxybutynin from the official website of the U.S. Food and Drug Administration.
49	FDA label for approved estradiol from the official website of the U.S. Food and Drug Administration.
50	Small molecule inhibitors of histone arginine methyltransferases: homology modeling, molecular docking, binding mode analysis, and biological evaluations. J Med Chem. 2007 Mar 22; 50(6):1241-53.
51	Bacterial metabolism rescues the inhibition of intestinal drug absorption by food and drug additives. Proc Natl Acad Sci U S A. 2020 Jul 7;117(27):16009-16018.

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