Distamycin A hydrochloride

Molecular Formula: C22H28ClN9O4


InChI: InChI=1/C22H27N9O4.ClH/c1-29-9-13(26-12-32)6-17(29)21(34)28-15-8-18(31(3)11-15)22(35)27-14-7-16(30(2)10-14)20(33)25-5-4-19(23)24;/h6-12H,4-5H2,1-3H3,(H3,23,24)(H,25,33)(H,26,32)(H,27,35)(H,28,34);1H/fC22H28N9O4.Cl/h23,25-28H,24H3;1h/q+1;-1/b23-19-;

InChIKey: InChIKey=SFYSJFJQEGCACQ-WNRWRGJMDE
SMILES: CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCC(=N)[NH3+])C)C)NC=O.[Cl-]

Names:
    Distamycin A hydrochloride
    NSC150528
    3-[[4-[[4-[(4-formamido-1-methyl-pyrrole-2-carbonyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carbonyl]amino]propanimidoylazanium chloride

Registries:
    PubChem CID 5458318
    PubChem ID 8140329