(7S,9S)-7-[(2R,4S,5S,6S)-4-[(4-aminophenyl)methylamino]-6-methyl-5-oxidanyl-oxan-2-yl]oxy-9-ethanoyl-4-methoxy-6,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione

Systemtic Name: (7S,9S)-7-[(2R,4S,5S,6S)-4-[(4-aminophenyl)methylamino]-6-methyl-5-oxidanyl-oxan-2-yl]oxy-9-ethanoyl-4-methoxy-6,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione Openeye Name: (7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-[(4-aminophenyl)methylamino]-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione CAS Name: (7S,9S)-9-acetyl-7-[[(2R,4S,5S,6S)-4-[(4-aminophenyl)methylamino]-5-hydroxy-6-methyl-2-oxanyl]oxy]-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione IUPAC Name: (7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-[(4-aminophenyl)methylamino]-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione Traditional Name: (7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-[(4-aminobenzyl)amino]-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-quinone Formula: C34H36N2O10 MolecularWeight: 632.65704

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)NCC6=CC=C(C=C6)N)O

Isomeric SMILES

C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)NCC6=CC=C(C=C6)N)O

InChI

InChI=1S/C34H36N2O10/c1-15-29(38)21(36-14-17-7-9-18(35)10-8-17)11-24(45-15)46-23-13-34(43,16(2)37)12-20-26(23)33(42)28-27(31(20)40)30(39)19-5-4-6-22(44-3)25(19)32(28)41/h4-10,15,21,23-24,29,36,38,40,42-43H,11-14,35H2,1-3H3/t15-,21-,23-,24-,29+,34-/m0/s1