10-Carboxy-13-Deoxocarminomycin
[CAS# 97583-07-8]

Identification

• Name: 10-Carboxy-13-Deoxocarminomycin
• Synonyms: (1R,2R,4S)-4-[(2R,4S,5S,6S)-4-Amino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-2-Ethyl-2,5,7,12-Tetrahydroxy-6,11-Dioxo-3,4-Dihydro-1H-Tetracene-1-Carboxylic Acid; (1R,2R,4S)-4-[[(2R,4S,5S,6S)-4-Amino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-2-Ethyl-2,
• Molecular Formula: C₂₇H₂₉NO₁₁
• Molecular Weight: 543.53
• CAS Registry Number: 97583-07-8
• SMILES: [C@H]3(C1=C(O)C5=C(C(=C1[C@@H](O[C@@H]2O[C@H]([C@@H](O)[C@@H](N)C2)C)C[C@]3(O)CC)O)C(=O)C4=C(O)C=CC=C4C5=O)C(=O)O
• InChI: 1S/C27H29NO11/c1-3-27(37)8-13(39-14-7-11(28)21(30)9(2)38-14)16-17(20(27)26(35)36)25(34)18-19(24(16)33)23(32)15-10(22(18)31)5-4-6-12(15)29/h4-6,9,11,13-14,20-21,29-30,33-34,37H,3,7-8,28H2,1-2H3,(H,35,36)/t9-,11-,13-,14-,20-,21+,27+/m0/s1
• InChIKey: MMYTYGXIKKVLES-AGMCFEMXSA-N

Properties

• Density: 1.654g/cm³ (Cal.)
• Boiling point: 745.47°C at 760 mmHg (Cal.)
• Flash point: 404.646°C (Cal.)