BEL
2,4-DINITRO,5-[BIS(2-BROMOETHYL)AMINO]-N-(2',3'-DIOXOPROPYL)BENZAMIDE
Find entries where: BEL
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | 2,4-DINITRO,5-[BIS(2-BROMOETHYL)AMINO]-N-(2',3'-DIOXOPROPYL)BENZAMIDE |
Identifiers | 5-(bis(2-bromoethyl)amino)-N-(2,3-dioxopropyl)-2,4-dinitro-benzamide |
Formula | C14 H14 Br2 N4 O7 |
Molecular Weight | 510.092 |
Type | NON-POLYMER |
Isomeric SMILES | c1c(c(cc(c1N(CCBr)CCBr)[N+](=O)[O-])[N+](=O)[O-])C(=O)NCC(=O)C=O |
InChI | InChI=1S/C14H14Br2N4O7/c15-1-3-18(4-2-16)12-5-10(14(23)17-7-9(22)8-21)11(19(24)25)6-13(12)20(26)27/h5-6,8H,1-4,7H2,(H,17,23) |
InChIKey | LECLJMCDJUEAKI-UHFFFAOYSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 41 |
Chiral Atom Count | 0 |
Bond Count | 41 |
Aromatic Bond Count | 6 |
Drug Info: DrugBank
DrugBank ID | DB04138 |
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Name | 5-[Bis(2-bromoethyl)amino]-N-(2,3-dioxopropyl)-2,4-dinitrobenzamide |
Groups | experimental |
Synonyms |
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Drug Targets
Name | Target Sequence | Pharmacological Action | Actions |
---|---|---|---|
Oxygen-insensitive NAD(P)H nitroreductase | MDIISVALKRHSTKAFDASKKLTPEQAEQIKTLLQYSPSSTNSQPWHFIV... | unknown |
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison
T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS.
Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682
Related Resource References
Resource Name | Reference |
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PubChem | 5287756 |