(2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[[5-[(2R)-2-Hydroxy-3-[2-(2-Methoxyphenoxy)Ethylamino]Propoxy]-9H-Carbazol-1-Yl]Oxy]Oxane-2-Carboxylic Acid
[CAS# 136657-39-1]

Identification

• Name: (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[[5-[(2R)-2-Hydroxy-3-[2-(2-Methoxyphenoxy)Ethylamino]Propoxy]-9H-Carbazol-1-Yl]Oxy]Oxane-2-Carboxylic Acid
• Synonyms: (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[[5-[(2R)-2-Hydroxy-3-[2-(2-Methoxyphenoxy)Ethylamino]Propoxy]-9H-Carbazol-1-Yl]Oxy]Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-[[5-[(2R)-2-Hydroxy-3-[2-(2-Methoxyphenoxy)Ethylamino]Propoxy]-9H-Carbazol-1-Yl]Oxy]-2-Tetrahydropyrancarboxylic Acid; 8-Ohcg
• Molecular Formula: C₃₀H₃₄N₂O₁₁
• Molecular Weight: 598.61
• CAS Registry Number: 136657-39-1
• SMILES: [C@@H]5(OC1=CC=CC2=C1[NH]C3=C2C(=CC=C3)OC[C@H](O)CNCCOC4=CC=CC=C4OC)O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(=O)O
• InChI: 1S/C30H34N2O11/c1-39-19-8-2-3-9-20(19)40-13-12-31-14-16(33)15-41-21-10-5-7-18-23(21)17-6-4-11-22(24(17)32-18)42-30-27(36)25(34)26(35)28(43-30)29(37)38/h2-11,16,25-28,30-36H,12-15H2,1H3,(H,37,38)/t16-,25+,26+,27-,28+,30-/m1/s1
• InChIKey: VNOMSNHAOHVOPZ-IVODMCMDSA-N

Properties

• Density: 1.475g/cm³ (Cal.)
• Boiling point: 937.691°C at 760 mmHg (Cal.)
• Flash point: 520.897°C (Cal.)