NSC43889

Molecular Formula: C31H36N4O11S


InChI: InChI=1/C31H36N4O11S/c1-29(2)22(28(43)44)35-26(42)18(27(35)47-29)32-10-33-25(41)17-21(38)19(34(4)5)13-9-12-16(23(39)31(13,46)24(17)40)20(37)15-11(30(12,3)45)7-6-8-14(15)36/h6-8,12-13,18-19,22,27,32-33,36-37,41,45-46H,9-10H2,1-5H3,(H,43,44)/b25-17+/f/h43H

InChIKey: InChIKey=CIQNAZPFOWKLQD-UUKAOIPZDU
SMILES: CC1(C(N2C(S1)C(C2=O)NCNC(=C3C(=O)C(C4CC5C(=C(C6=C(C5(C)O)C=CC=C6O)O)C(=O)C4(C3=O)O)N(C)C)O)C(=O)O)C

Names:
    NSC43889
    6-[[[(E)-(4-dimethylamino-6,10,11,12a-tetrahydroxy-6-methyl-1,3,12-trioxo-4,4a,5,5a-tetrahydrotetracen-2-ylidene)-hydroxy-methyl]amino]methylamino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Registries:
    PubChem CID 5355703
    PubChem ID 98176