Details of the Drug

General Information of Drug (ID: DMSXM7E)

Drug Name

Hexyl

Synonyms

Dipicrylamine; Hexyl; Hexanitrodiphenylamine; Aurantia; Hexite; Hexil; Bis(2,4,6-trinitrophenyl)amine; Hexyl (reagent); 131-73-7; Esanitrodifenilamina; Hexanitrodifenylamine; Diphenylamine, hexanitro-; Dipikrylamin; Hexamine (potassium reagent); Hexyl (VAN); Dipikrylamin [Czech]; Hexyl [German, Dutch]; 2,2',4,4',6,6'-HEXANITRODIPHENYLAMINE; UNII-14STR4KG8T; NSC 1786; Hexanitrodifenylamine [Dutch]; Esanitrodifenilamina [Italian]; Hexanitrodiphenylamine [French]; CCRIS 5347; 2,4,6,2',4',6'-Hexanitrodiphenylamine; HSDB 2873; C.I. 10360

Indication

Disease Entry	ICD 11	Status	REF
Radiation syndrome	NF00	Phase 3	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

Chemical Identifiers

Formula: C12H5N7O12
Canonical SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
InChI: 1S/C12H5N7O12/c20-14(21)5-1-7(16(24)25)11(8(2-5)17(26)27)13-12-9(18(28)29)3-6(15(22)23)4-10(12)19(30)31/h1-4,13H
InChIKey: CBCIHIVRDWLAME-UHFFFAOYSA-N

Cross-matching ID

PubChem CID: 8576
CAS Number: 131-73-7
TTD ID: D0E0HE

References

1	ClinicalTrials.gov (NCT00052637) Cystoscopy and Hexyl 5-Aminolevulinate in Detecting Carcinoma In Situ in Patients With Bladder Cancer. U.S. National Institutes of Health.