azanide; bis(chloranyl)platinum(2+); (7S,9S)-4-methoxy-7-[(2R,4S,5S,6S)-4-[(2S)-2-methoxymorpholin-4-yl]-6-methyl-5-oxidanyl-oxan-2-yl]oxy-6,9,11-tris(oxidanyl)-9-(2-oxidanylethanoyl)-8,10-dihydro-7H-tetracene-5,12-dione; hydrochloride

Systemtic Name: azanide; bis(chloranyl)platinum(2+); (7S,9S)-4-methoxy-7-[(2R,4S,5S,6S)-4-[(2S)-2-methoxymorpholin-4-yl]-6-methyl-5-oxidanyl-oxan-2-yl]oxy-6,9,11-tris(oxidanyl)-9-(2-oxidanylethanoyl)-8,10-dihydro-7H-tetracene-5,12-dione; hydrochloride Openeye Name: azanide; dichloroplatinum(2+); (7S,9S)-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-7-[(2R,4S,5S,6S)-5-hydroxy-4-[(2S)-2-methoxymorpholin-4-yl]-6-methyl-tetrahydropyran-2-yl]oxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione; hydrochloride CAS Name: azanide; dichloroplatinum(2+); (7S,9S)-6,9,11-trihydroxy-7-[[(2R,4S,5S,6S)-5-hydroxy-4-[(2S)-2-methoxy-4-morpholinyl]-6-methyl-2-oxanyl]oxy]-9-(2-hydroxy-1-oxoethyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione; hydrochloride IUPAC Name: azanide; dichloroplatinum(2+); (7S,9S)-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-7-[(2R,4S,5S,6S)-5-hydroxy-4-[(2S)-2-methoxymorpholin-4-yl]-6-methyloxan-2-yl]oxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione; hydrochloride Traditional Name: azanide; dichloroplatinum(2+); (7S,9S)-9-glycoloyl-6,9,11-trihydroxy-7-[(2R,4S,5S,6S)-5-hydroxy-4-[(2S)-2-methoxymorpholino]-6-methyl-tetrahydropyran-2-yl]oxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-quinone; hydrochloride Formula: C32H42Cl3N3O13Pt MolecularWeight: 978.12518

Click to see the large picture

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)CO)O)N6CCOC(C6)OC)O.[NH2-].[NH2-].Cl.Cl[Pt+2]Cl

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)CO)O)N6CCO[C@@H](C6)OC)O.[NH2-].[NH2-].Cl.Cl[Pt+2]Cl

InChI

InChI=1S/C32H37NO13.3ClH.2H2N.Pt/c1-14-27(36)17(33-7-8-44-22(12-33)43-3)9-21(45-14)46-19-11-32(41,20(35)13-34)10-16-24(19)31(40)26-25(29(16)38)28(37)15-5-4-6-18(42-2)23(15)30(26)39;;;;;;/h4-6,14,17,19,21-22,27,34,36,38,40-41H,7-13H2,1-3H3;3*1H;2*1H2;/q;;;;2*-1;+4/p-2/t14-,17-,19-,21-,22-,27+,32-;;;;;;/m0....../s1