4-Epitetracycline
[CAS# 79-85-6]

Identification

• Name: 4-Epitetracycline
• Synonyms: (4R,4As,5As,6S,12As)-2-(Amino-Hydroxymethylidene)-4-Dimethylamino-6,10,11,12A-Tetrahydroxy-6-Methyl-4,4A,5,5A-Tetrahydrotetracene-1,3,12-Trione; (2Z,4R,4As,5As,6S,12As)-2-(Amino-Hydroxy-Methylene)-4-Dimethylamino-6,10,11,12A-Tetrahydroxy-6-Methyl-4,4A,5,5A-Tetrahydrotetracene-1,3,12-Trione; (4R,4As,5As,6S,12As)-2-(Amino-Hydroxy-Methylene)-4-Dimethylamino-6,10,11,12A-Tetrahydroxy-6-Methyl-4,4A,5,5A-Tetrahydrotetracene-1,3,12-Trione
• Molecular Formula: C₂₂H₂₄N₂O₈
• Molecular Weight: 444.44
• CAS Registry Number: 79-85-6
• SMILES: [C@@H]23C[C@@H]1[C@](O)(C4=C(C(=C1C(=O)[C@]2(O)C(=O)\C(C(=O)[C@@H]3N(C)C)=C(/O)N)O)C(=CC=C4)O)C
• InChI: 1S/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/b20-14-/t9-,10-,15+,21+,22-/m0/s1
• InChIKey: JYHCQVWYCGHXGP-DWEHBZJNSA-N

Properties

• Density: 1.644g/cm³ (Cal.)
• Boiling point: 682.757°C at 760 mmHg (Cal.)
• Flash point: 366.718°C (Cal.)