(7S,9R,10R)-7-[(2R,4S,5S,6S)-4-Amino-5-Hydroxy-6-Methyloxan-2-Yl]Oxy-9-Ethyl-4,6,9,10,11-Pentahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione
[CAS# 105615-58-5]

Identification

• Name: (7S,9R,10R)-7-[(2R,4S,5S,6S)-4-Amino-5-Hydroxy-6-Methyloxan-2-Yl]Oxy-9-Ethyl-4,6,9,10,11-Pentahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione
• Synonyms: (7S,9R,10R)-7-[(2R,4S,5S,6S)-4-Amino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-9-Ethyl-4,6,9,10,11-Pentahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; (7S,9R,10R)-7-[[(2R,4S,5S,6S)-4-Amino-5-Hydroxy-6-Methyl-2-Tetrahydropyranyl]Oxy]-9-Ethyl-4,6,9,10,11-Pentahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Dione; (7S,9R,10R)-7-[(2R,4S,5S,6S)-4-Amino-5-Hydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-9-Ethyl-4,6,9,10,11-Pentahydroxy-8,10-Dihydro-7H-Tetracene-5,12-Quinone
• Molecular Formula: C₂₆H₂₉NO₁₀
• Molecular Weight: 515.52
• CAS Registry Number: 105615-58-5
• SMILES: [C@@H]3(O)C1=C(O)C4=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)C5=C(C4=O)C=CC=C5O
• InChI: 1S/C26H29NO10/c1-3-26(35)8-13(37-14-7-11(27)20(29)9(2)36-14)16-19(25(26)34)24(33)17-18(23(16)32)22(31)15-10(21(17)30)5-4-6-12(15)28/h4-6,9,11,13-14,20,25,28-29,32-35H,3,7-8,27H2,1-2H3/t9-,11-,13-,14-,20+,25+,26+/m0/s1
• InChIKey: LKBBOPGQDRPCDS-YAOXHJNESA-N

Properties

• Density: 1.633g/cm³ (Cal.)
• Boiling point: 687.281°C at 760 mmHg (Cal.)
• Flash point: 369.454°C (Cal.)