N-[(5aR,6aS,7S,9Z,10aS)-9-(Amino-Hydroxymethylidene)-4,7-Bis(Dimethylamino)-1,10a,12-Trihydroxy-8,10,11-Trioxo-5a,6,6a,7-Tetrahydro-5H-Tetracen-2-Yl]-2-Dimethylaminoacetamide
[CAS# 151922-16-6]

Identification

• Name: N-[(5aR,6aS,7S,9Z,10aS)-9-(Amino-Hydroxymethylidene)-4,7-Bis(Dimethylamino)-1,10a,12-Trihydroxy-8,10,11-Trioxo-5a,6,6a,7-Tetrahydro-5H-Tetracen-2-Yl]-2-Dimethylaminoacetamide
• Synonyms: N-[(5Ar,6As,7S,9Z,10As)-9-(Amino-Hydroxy-Methylene)-4,7-Bis(Dimethylamino)-1,10A,12-Trihydroxy-8,10,11-Trioxo-5A,6,6A,7-Tetrahydro-5H-Tetracen-2-Yl]-2-Dimethylamino-Acetamide; N-[(5Ar,6As,7S,9Z,10As)-9-(Amino-Hydroxymethylene)-4,7-Bis(Dimethylamino)-1,10A,12-Trihydroxy-8,10,11-Trioxo-5A,6,6A,7-Tetrahydro-5H-Tetracen-2-Yl]-2-Dimethylaminoacetamide; N-[(5Ar,6As,7S,9Z,10As)-9-(Amino-Hydroxy-Methylene)-4,7-Bis(Dimethylamino)-1,10A,12-Trihydroxy-8,10,11-Triketo-5A,6,6A,7-Tetrahydro-5H-Tetracen-2-Yl]-2-Dimethylamino-Acetamide
• Molecular Formula: C₂₇H₃₅N₅O₈
• Molecular Weight: 557.60
• CAS Registry Number: 151922-16-6
• SMILES: [C@H]34[C@](O)(C(=O)C2=C(O)C1=C(O)C(=CC(=C1C[C@H]2C3)N(C)C)NC(=O)CN(C)C)C(=O)\C(C(=O)[C@H]4N(C)C)=C(/O)N
• InChI: 1S/C27H35N5O8/c1-30(2)10-16(33)29-14-9-15(31(3)4)12-7-11-8-13-20(32(5)6)23(36)19(26(28)39)25(38)27(13,40)24(37)17(11)22(35)18(12)21(14)34/h9,11,13,20,34-35,39-40H,7-8,10,28H2,1-6H3,(H,29,33)/b26-19-/t11-,13-,20-,27-/m0/s1
• InChIKey: JZAMDXHGHIDDRI-SACIJHIESA-N

Properties

• Density: 1.512g/cm³ (Cal.)
• Boiling point: 761.046°C at 760 mmHg (Cal.)
• Flash point: 414.066°C (Cal.)