(2Z,4S,4aS,5aS,6R,12aS)-2-(Amino-Hydroxy-Methylidene)-7-Bromo-4-Dimethylamino-6,10,11,12a-Tetrahydroxy-6-Methyl-4,4a,5,5a-Tetrahydrotetracene-1,3,12-Trione
[CAS# 4572-56-9]

Identification

• Name: (2Z,4S,4aS,5aS,6R,12aS)-2-(Amino-Hydroxy-Methylidene)-7-Bromo-4-Dimethylamino-6,10,11,12a-Tetrahydroxy-6-Methyl-4,4a,5,5a-Tetrahydrotetracene-1,3,12-Trione
• Synonyms: (2Z,4S,4As,5As,6R,12As)-2-(Amino-Hydroxy-Methylene)-7-Bromo-4-Dimethylamino-6,10,11,12A-Tetrahydroxy-6-Methyl-4,4A,5,5A-Tetrahydrotetracene-1,3,12-Trione; (2Z,4S,4As,5As,6R,12As)-2-(Amino-Hydroxymethylene)-7-Bromo-4-Dimethylamino-6,10,11,12A-Tetrahydroxy-6-Methyl-4,4A,5,5A-Tetrahydrotetracene-1,3,12-Trione; (2Z,4S,4As,5As,6R,12As)-2-(Amino-Hydroxy-Methylidene)-7-Bromo-4-Dimethylamino-6,10,11,12A-Tetrahydroxy-6-Methyl-4,4A,5,5A-Tetrahydrotetracene-1,3,12-Trione
• Molecular Formula: C₂₂H₂₃BrN₂O₈
• Molecular Weight: 523.34
• CAS Registry Number: 4572-56-9
• SMILES: [C@@H]34C[C@@H]2[C@@](O)(C1=C(Br)C=CC(=C1C(=C2C(=O)[C@]3(O)C(=O)\C(C(=O)[C@H]4N(C)C)=C(/O)N)O)O)C
• InChI: 1S/C22H23BrN2O8/c1-21(32)7-6-8-15(25(2)3)17(28)13(20(24)31)19(30)22(8,33)18(29)11(7)16(27)12-10(26)5-4-9(23)14(12)21/h4-5,7-8,15,26-27,31-33H,6,24H2,1-3H3/b20-13-/t7-,8-,15-,21+,22-/m0/s1
• InChIKey: NRGSURLQXFKFCW-FDEDCWAHSA-N

Properties

• Density: 1.849g/cm³ (Cal.)
• Boiling point: 707.241°C at 760 mmHg (Cal.)
• Flash point: 381.526°C (Cal.)