1.02010-04-08 22:10:27 UTC2019-11-26 03:07:49 UTCFDB012974MerceneneIsolated from the common clam Mercenaria mercenaria and from Mercenaria campechiensis
Carmustine is one of the nitrosoureas indicated as palliative therapy as a single agent or in established combination therapy with other approved chemotherapeutic agents in treatment of brain tumors, multiple myeloma, Hodgkin's disease, and non-Hodgkin's lymphomas. Although it is generally agreed that carmustine alkylates DNA and RNA, it is not cross resistant with other alkylators. As with other nitrosoureas, it may also inhibit several key enzymatic processes by carbamoylation of amino acids in proteins. Mercenene is found in mollusks.1,3-Bis(2-Chloroethyl)-1-Nitrosourea1,3-Bis(2-chloroethyl)nitrosourea1,3-Bis(beta-chloroethyl)-1-nitrosourea1,3-BIS(CHLOROETHYL)-1-NITROSOUREABCNUBcnu [chloroethyl nitrosoureas]BecenumBi cnuBicnuBicnu (TN)Bis-n,n'-(chloroethyl)nitrosoureaBis(2-chloroethyl)1-nitrosoureaBis(2-chloroethyl)nitrosoureaBis(chloroethyl)nitrosoureaBischlorethylnitrosoureaBischlorethylnitrosureaBischloroethyl nitrosoureaBischloroethyl nitrosourea [chloroethyl nitrosoureas]BischloroethylnitrosoureaCarmubrisCarmustinCarmustinaCarmustineCarmustine (usan/inn)Carmustine [usan:inn:ban]Carmustine in ethanolCarmustinumFIVBGliadelN,N'-Bis(2-Chloroethyl)-N-NitrosoureaNitrumonUrea, 1,3-bis(2-chloroethyl)-1-nitroso-Urea, N,N'-bis(2-chloroethyl)-N-nitroso-C5H9Cl2N3O2214.05213.0071819611,3-bis(2-chloroethyl)-3-nitrosoureacarmustine154-93-8ClCCNC(=O)N(CCCl)N=OInChI=1S/C5H9Cl2N3O2/c6-1-3-8-5(11)10(9-12)4-2-7/h1-4H2,(H,8,11)DLGOEMSEDOSKAD-UHFFFAOYSA-N belongs to the class of organic compounds known as nitrosoureas. Nitrosoureas are compounds containing a nitro group and an urea group N-N linked together, with the general structure R1N(R2)C(=O)N(R3)N=O.NitrosoureasOrganic compoundsOrganic acids and derivativesOrganic carbonic acids and derivativesUreasAliphatic acyclic compoundsAlkyl chloridesCarbonyl compoundsHydrocarbon derivativesNitrosamidesOrganic oxidesOrganochloridesOrganopnictogen compoundsSemicarbazidesAliphatic acyclic compoundAlkyl chlorideAlkyl halideCarbonyl groupHydrocarbon derivativeNitrosamideNitrosoureaOrganic n-nitroso compoundOrganic nitrogen compoundOrganic nitroso compoundOrganic oxideOrganic oxygen compoundOrganochlorideOrganohalogen compoundOrganonitrogen compoundOrganooxygen compoundOrganopnictogen compoundSemicarbazideN-nitrosoureasorganochlorine compoundSolidlogp1.24logs-2.15solubility1.53e+00 g/llogp1.02pka_strongest_acidic11.96pka_strongest_basic-5.3iupac1,3-bis(2-chloroethyl)-3-nitrosoureaaverage_mass214.05mono_mass213.007181961smilesClCCNC(=O)N(CCCl)N=OformulaC5H9Cl2N3O2inchiInChI=1S/C5H9Cl2N3O2/c6-1-3-8-5(11)10(9-12)4-2-7/h1-4H2,(H,8,11)inchikeyDLGOEMSEDOSKAD-UHFFFAOYSA-Npolar_surface_area61.77refractivity46.98polarizability18.8rotatable_bond_count5acceptor_count2donor_count1physiological_charge0formal_charge0Specdb::CMs21509Specdb::CMs130538Specdb::CMs138272Specdb::MsMs51651Specdb::MsMs51652Specdb::MsMs51653Specdb::MsMs158934Specdb::MsMs158935Specdb::MsMs158936Specdb::MsMs2471178Specdb::MsMs2471179Specdb::MsMs2471180Specdb::MsMs2493905Specdb::MsMs2493906Specdb::MsMs2493907HMDB144073423MollusksUnknowngeneric6447