ethyl (E)-2-[[10-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-8-ethanoyl-1-methoxy-8,12-bis(oxidanyl)-6,11-bis(oxidanylidene)-9,10-dihydro-7H-tetracen-5-yl]amino]but-2-enoate

Systemtic Name: ethyl (E)-2-[[10-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-8-ethanoyl-1-methoxy-8,12-bis(oxidanyl)-6,11-bis(oxidanylidene)-9,10-dihydro-7H-tetracen-5-yl]amino]but-2-enoate Openeye Name: ethyl (E)-2-[[8-acetyl-10-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-8,12-dihydroxy-1-methoxy-6,11-dioxo-9,10-dihydro-7H-tetracen-5-yl]amino]but-2-enoate CAS Name: (E)-2-[[8-acetyl-10-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-8,12-dihydroxy-1-methoxy-6,11-dioxo-9,10-dihydro-7H-tetracen-5-yl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-2-[[8-acetyl-10-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-8,12-dihydroxy-1-methoxy-6,11-dioxo-9,10-dihydro-7H-tetracen-5-yl]amino]but-2-enoate Traditional Name: (E)-2-[[8-acetyl-10-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-8,12-dihydroxy-6,11-diketo-1-methoxy-9,10-dihydro-7H-tetracen-5-yl]amino]but-2-enoic acid ethyl ester Formula: C33H38N2O11 MolecularWeight: 638.66162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC)NC1=C2C(=C(C3=C1C=CC=C3OC)O)C(=O)C4=C(C2=O)CC(CC4OC5CC(C(C(O5)C)O)N)(C(=O)C)O

Isomeric SMILES

CCOC(=O)/C(=C\C)/NC1=C2C(=C(C3=C1C=CC=C3OC)O)C(=O)C4=C(C2=O)CC(CC4OC5CC(C(C(O5)C)O)N)(C(=O)C)O

InChI

InChI=1S/C33H38N2O11/c1-6-19(32(41)44-7-2)35-27-16-9-8-10-20(43-5)23(16)30(39)26-25(27)29(38)17-12-33(42,15(4)36)13-21(24(17)31(26)40)46-22-11-18(34)28(37)14(3)45-22/h6,8-10,14,18,21-22,28,35,37,39,42H,7,11-13,34H2,1-5H3/b19-6+