6-demethylmitomycin B
Chemical Formula:
C15H15N3O6
Molecular Weight:
333.3 Daltons
Monoisotopic Mass:
334.10391026179997 Daltons
SMILES:
CC4(=C([O-])C(=O)C3(=C(N2(C[CH]1(N(C)[CH]1C(O)2C(COC(=O)N)3)))C(=O)4))
InChI:
1S/C15H16N3O6/c1-5-10(19)9-8(12(21)11(5)20)6(4-24-14(16)22)15(23)13-7(17(13)2)3-18(9)15/h7,13,20,23H,3-4H2,1-2H3,(H2,16,22)/p-1/t7-,13-,15+,17?/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-17522
MetaNetX:
MNXM146513
KEGG:
C21164