(7S,9S)-7-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-9-ethanoyl-4-ethoxy-6,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione

Systemtic Name: (7S,9S)-7-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-9-ethanoyl-4-ethoxy-6,9,11-tris(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione Openeye Name: (7S,9S)-9-acetyl-7-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-4-ethoxy-6,9,11-trihydroxy-8,10-dihydro-7H-tetracene-5,12-dione CAS Name: (7S,9S)-9-acetyl-7-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-4-ethoxy-6,9,11-trihydroxy-8,10-dihydro-7H-tetracene-5,12-dione IUPAC Name: (7S,9S)-9-acetyl-7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-4-ethoxy-6,9,11-trihydroxy-8,10-dihydro-7H-tetracene-5,12-dione Traditional Name: (7S,9S)-9-acetyl-7-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-4-ethoxy-6,9,11-trihydroxy-8,10-dihydro-7H-tetracene-5,12-quinone Formula: C28H31NO10 MolecularWeight: 541.54644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=C4CC(CC(C4=C3O)OC5CC(C(C(O5)C)O)N)(C(=O)C)O)O

Isomeric SMILES

CCOC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=C4C[C@](C[C@@H](C4=C3O)OC5CC(C(C(O5)C)O)N)(C(=O)C)O)O

InChI

InChI=1S/C28H31NO10/c1-4-37-16-7-5-6-13-19(16)26(34)22-21(24(13)32)25(33)14-9-28(36,12(3)30)10-17(20(14)27(22)35)39-18-8-15(29)23(31)11(2)38-18/h5-7,11,15,17-18,23,31,33,35-36H,4,8-10,29H2,1-3H3/t11?,15?,17-,18?,23?,28-/m0/s1