Sulfurmycin C
[CAS# 83753-75-7]

Identification

• Name: Sulfurmycin C
• Synonyms: Methyl (1R,2S,4S)-2-Acetonyl-4-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-4,5-Dihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Dimethylamino-6-Methyl-Tetrahydropyran-2-Yl]Oxy-2,5,7-Trihydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracene-1-Carboxylate; (1R,2S,4S)-2-Acetonyl-4-[[(2R,4S,5S,6S)-5-[[(2S,4S,5S,6S)-4,5-Dihydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-4-Dimethylamino-6-Methyl-2-Tetrahydropyranyl]Oxy]-2,5,7-Trihydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracene-1-Carboxylic Acid Methyl Ester; (1R,2S,4S)-2-Acetonyl-4-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-4,5-Dihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-4-Dimethylamino-6-Methyl-Tetrahydropyran-2-Yl]Oxy-2,5,7-Trihydroxy-6,11-Diketo-3,4-Dihydro-1H-Tetracene-1-Carboxylic Acid Methyl Ester
• Molecular Formula: C₃₇H₄₅NO₁₄
• Molecular Weight: 727.76
• CAS Registry Number: 83753-75-7
• SMILES: [C@H]4(C1=CC6=C(C(=C1[C@@H](O[C@@H]3O[C@H]([C@@H](O[C@@H]2O[C@H]([C@@H](O)[C@@H](O)C2)C)[C@@H](N(C)C)C3)C)C[C@]4(O)CC(=O)C)O)C(=O)C5=C(O)C=CC=C5C6=O)C(OC)=O
• InChI: 1S/C37H45NO14/c1-15(39)13-37(47)14-24(51-25-11-21(38(4)5)35(17(3)50-25)52-26-12-23(41)31(42)16(2)49-26)28-19(30(37)36(46)48-6)10-20-29(34(28)45)33(44)27-18(32(20)43)8-7-9-22(27)40/h7-10,16-17,21,23-26,30-31,35,40-42,45,47H,11-14H2,1-6H3/t16-,17-,21-,23-,24-,25-,26-,30-,31+,35+,37+/m0/s1
• InChIKey: PSUQQLCSYKMETC-JUMBGEQRSA-N

Properties

• Density: 1.476g/cm³ (Cal.)
• Boiling point: 851.856°C at 760 mmHg (Cal.)
• Flash point: 468.985°C (Cal.)