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

Systemtic Name: (9R)-9-[(2S,4S,5S,6S)-4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl]oxy-9-ethanoyl-4-methoxy-6,11-bis(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione Openeye Name: (9R)-9-acetyl-9-[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,11-dihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione CAS Name: (9R)-9-acetyl-9-[[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-2-oxanyl]oxy]-6,11-dihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione IUPAC Name: (9R)-9-acetyl-9-[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,11-dihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione Traditional Name: (9R)-9-acetyl-9-[(2S,4S,5S,6S)-4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-6,11-dihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-quinone Formula: C27H29NO9 MolecularWeight: 511.52046

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)OC2(CCC3=C(C4=C(C(=C3C2)O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)C(=O)C)N)O

Isomeric SMILES

C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@@]2(CCC3=C(C4=C(C(=C3C2)O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)C(=O)C)N)O

InChI

InChI=1S/C27H29NO9/c1-11-22(30)16(28)9-18(36-11)37-27(12(2)29)8-7-13-15(10-27)25(33)20-21(23(13)31)26(34)19-14(24(20)32)5-4-6-17(19)35-3/h4-6,11,16,18,22,30-31,33H,7-10,28H2,1-3H3/t11-,16-,18-,22+,27+/m0/s1