Details of the Drug Inactive Ingredient (DIG)

General Information of DIG (ID: E0DI4R)
DIG Name	Lithol rubin BCA
Synonyms	Click to Show/Hide the Synonyms of This DIG 5281-04-9; D&C Red No. 7; Brilliant Carmine 6B; Lithol Rubin BCA; D&C Red 7; C.I. Pigment Red 57, calcium salt; UNII-ECW0LZ41X8; ECW0LZ41X8; C.I. Pigment Red 57, calcium salt (1:1); C.I. 15850:1; E180; Calcium 3-hydroxy-4-((4-methyl-2-sulphonatophenyl)azo)-2-naphthoate; Calcium 3-hydroxy-4-(4-methyl-2-sulphonatophenyl)azo-2-naphthoate; 2-Naphthalenecarboxylic acid, 3-hydroxy-4-((4-methyl-2-sulfophenyl)azo)-, calcium salt (1:1); 2-Naphthalenecarboxylic acid, 3-hydroxy-4-[(4-methyl-2-sulfophenyl)azo]-, calcium salt (1:1); Lithol rubin B ca; D & C Red no. 7; C.I. Pigment Red 57:1; CCRIS 4903; calcium 3-hydroxy-4-[(4-methyl-2-sulphonatophenyl)azo]-2-naphthoate; CI 15850:1 (Ca salt); 2-Naphthalenecarboxylic acid, 3-hydroxy-4-(2-(4-methyl-2-sulfophenyl)diazenyl)-, calcium salt (1:1); 2-Naphthalenecarboxylic acid, 3-hydroxy-4-[2-(4-methyl-2-sulfophenyl)diazenyl]-, calcium salt (1:1); EINECS 226-109-5; DSSTox_CID_7594; DSSTox_RID_78520; DSSTox_GSID_27594; SCHEMBL341670; SCHEMBL3184572; CHEMBL2028348; DTXSID7027594; DTXSID30967273; Tox21_202750; MFCD00059529; 2-Naphthalenecarboxylic acid, 3-hydroxy-4-((4-methyl-2-sulfophenyl)azo)-, calcium salt; 3-Hydroxy-4-((2-sulfo-p-tolyl)azo)-2-naphthalenecarboxylic acid, calcium salt (1:1); 3-Hydroxy-4-((4-methyl-2-sulfophenyl)azo)-2-naphthalenecarboxylic acid, calcium salt; NCGC00260298-01; 5281-09-4; CAS-5281-04-9; L0075; EC 226-109-5; W-109152; Q27095541; 3-Hydroxy-4-[(4-methyl-2-sulfophenyl)azo]-2-naphthoic acid calcium salt; Calcium 3-hydroxy-4-((4-methyl-2-sulfonatophenyl)diazenyl)-2-naphthoate; calcium 3-hydroxy-4-[(E)-(4-methyl-2-sulfonatophenyl)diazenyl]-2-naphthoate; Calcium 4-[2-(4-methyl-2-sulfonatophenyl)hydrazinylidene]-3-oxo-3,4-dihydronaphthalene-2-carboxylate
DIG Function	Colorant
PubChem CID	135423095
Formula	C18H12CaN2O6S
Canonical SMILES	CC1=CC(=C(C=C1)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)O)[O-])S(=O)(=O)[O-].[Ca+2]
InChI	1S/C18H14N2O6S.Ca/c1-10-6-7-14(15(8-10)27(24,25)26)19-20-16-12-5-3-2-4-11(12)9-13(17(16)21)18(22)23;/h2-9,21H,1H3,(H,22,23)(H,24,25,26);/q;+2/p-2
InChIKey	PZTQVMXMKVTIRC-UHFFFAOYSA-L
	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=135423095"></iframe>
Structure	3D MOL is not available		2D MOL
Physicochemical Properties	Molecular Weight	424.4	Topological Polar Surface Area	151
	XlogP	N.A.	Complexity	663
	Heavy Atom Count	28	Rotatable Bond Count	3
	Hydrogen Bond Donor Count	1	Hydrogen Bond Acceptor Count	8

Full List of Active Pharmaceutical Ingredients (APIs) Co-administrated with This DIG
ICD Disease Classification 02		Benign/in-situ/malignant neoplasm	Click to Show/Hide
Temozolomide	API Info	Brain cancer [ICD-11: 2A00]		[1]
ICD Disease Classification 05		Endocrine/nutritional/metabolic disease	Click to Show/Hide
Levothroid	API Info	Hypothyroidism [ICD-11: 5A00]		[2]
ICD Disease Classification 06		Mental/behavioural/neurodevelopmental disorder	Click to Show/Hide
Bupropion	API Info	Nicotine dependence [ICD-11: 6C4A]		[3]
Amitriptyline	API Info	Major depressive disorder [ICD-11: 6A70]		[4]
Oxazepam	API Info	Anxiety disorder [ICD-11: 6B00]		[5]
Tranylcypromine	API Info	Major depressive disorder [ICD-11: 6A70]		[6]
ICD Disease Classification 07		Sleep-wake disorder	Click to Show/Hide
Dextroamphetamine	API Info	Narcolepsy [ICD-11: 7A20]		[7]
ICD Disease Classification 08		Nervous system disease	Click to Show/Hide
Acetaminophen	API Info	Anaesthesia [ICD-11: 8E22]		[8]
Morphine	API Info	Anaesthesia [ICD-11: 8E22]		[9]
Tramadol	API Info	Anaesthesia [ICD-11: 8E22]		[10]
Methylergonovine	API Info	Migraine [ICD-11: 8A80]		[11]
ICD Disease Classification 10		Ear/mastoid process disease	Click to Show/Hide
Diphenhydramine	API Info	Meniere disease [ICD-11: AB31]		[12]
ICD Disease Classification 11		Circulatory system disease	Click to Show/Hide
Aspirin	API Info	Myocardial infarction [ICD-11: BA41]		[13]
Dipyridamole	API Info	Atherosclerosis [ICD-11: BA80]		[14]
ICD Disease Classification 13		Digestive system disease	Click to Show/Hide
Omeprazole	API Info	Gastro-oesophageal reflux disease [ICD-11: DA22]		[15]
Bisacodyl	API Info	Irritable bowel syndrome [ICD-11: DD91]		[16]
Sodium fluoride	API Info	Periodontal disease [ICD-11: DA0C]		[17]
ICD Disease Classification 14		Skin disease	Click to Show/Hide
Isotretinoin	API Info	Acne vulgaris [ICD-11: ED80]		[18]
Demeclocycline	API Info	Acne vulgaris [ICD-11: ED80]		[19]
ICD Disease Classification 15		Musculoskeletal/connective-tissue disease	Click to Show/Hide
Indomethacin	API Info	Rheumatoid arthritis [ICD-11: FA20]		[20]
Conjugated estrogen	API Info	Osteoporosis [ICD-11: FB83]		[21]
ICD Disease Classification 16		Genitourinary system disease	Click to Show/Hide
Erythromycin	API Info	Pelvic inflammatory disease [ICD-11: GA05]		[22]

References
1	FDA label for approved temozolomide from the official website of the U.S. Food and Drug Administration.
2	FDA label for approved levothroid from the official website of the U.S. Food and Drug Administration.
3	FDA label for approved bupropion from the official website of the U.S. Food and Drug Administration.
4	FDA label for approved amitriptyline from the official website of the U.S. Food and Drug Administration.
5	FDA label for approved oxazepam from the official website of the U.S. Food and Drug Administration.
6	FDA label for approved tranylcypromine from the official website of the U.S. Food and Drug Administration.
7	FDA label for approved dextroamphetamine from the official website of the U.S. Food and Drug Administration.
8	FDA label for approved acetaminophen from the official website of the U.S. Food and Drug Administration.
9	FDA label for approved morphine from the official website of the U.S. Food and Drug Administration.
10	FDA label for approved tramadol from the official website of the U.S. Food and Drug Administration.
11	FDA label for approved methylergonovine from the official website of the U.S. Food and Drug Administration.
12	FDA label for approved diphenhydramine from the official website of the U.S. Food and Drug Administration.
13	FDA label for approved aspirin from the official website of the U.S. Food and Drug Administration.
14	FDA label for approved dipyridamole from the official website of the U.S. Food and Drug Administration.
15	FDA label for approved omeprazole from the official website of the U.S. Food and Drug Administration.
16	FDA label for approved bisacodyl from the official website of the U.S. Food and Drug Administration.
17	FDA label for approved sodium fluoride from the official website of the U.S. Food and Drug Administration.
18	FDA label for approved isotretinoin from the official website of the U.S. Food and Drug Administration.
19	FDA label for approved demeclocycline from the official website of the U.S. Food and Drug Administration.
20	FDA label for approved indomethacin from the official website of the U.S. Food and Drug Administration.
21	FDA label for approved conjugated estrogen from the official website of the U.S. Food and Drug Administration.
22	FDA label for approved erythromycin from the official website of the U.S. Food and Drug Administration.

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