NSC64453

Molecular Formula: C36H42Cl2N4O10


InChI: InChI=1/C36H42Cl2N4O10/c1-35(51)20-5-4-6-24(43)25(20)29(44)26-21(35)16-22-28(41(2)3)30(45)27(32(47)36(22,52)31(26)46)33(48)40-17-39-23(34(49)50)15-18-7-9-19(10-8-18)42(13-11-37)14-12-38/h4-10,21-23,28,39-40,43-44,48,51-52H,11-17H2,1-3H3,(H,49,50)/b33-27+/t21-,22-,23u,28-,35+,36-/m0/s1/f/h49H

InChIKey: InChIKey=OBFXCCGQYHAIEL-NKILDMGODQ
SMILES: CC1(C2CC3C(C(=O)C(=C(NCNC(CC4=CC=C(C=C4)N(CCCl)CCCl)C(=O)O)O)C(=O)C3(C(=O)C2=C(C5=C1C=CC=C5O)O)O)N(C)C)O

Names:
    L-Alanine, 3-[p-[bis(2-chloroethyl)amino]phenyl]-N-[[4-(dimethylamino)-1,4, 4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1, 11-dioxo-2-naphthacenecarboxamido]methyl]-
    L-Phenylalanine, 4-[bis(2-chloroethyl)amino]-N-[[[[4-(dimethylamino)-1,4,4a,5,5a,6, 11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1, 11-dioxo-2-naphthacenyl]carbonyl]amino]methyl]-, [4S-(4.alpha., 4a.alpha.,5a.alpha.,6.beta.,12a.alpha.)]-
    NSC64453
    2-[[[(E)-[(4S,4aS,5aS,6S,12aS)-4-dimethylamino-6,10,11,12a-tetrahydroxy-6-methyl-1,3,12-trioxo-4,4a,5,5a-tetrahydrotetracen-2-ylidene]-hydroxy-methyl]amino]methylamino]-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid

Registries:
    PubChem CID 5356651
    PubChem ID 110322