6'-(1-Amino-2-Hydroxyethyl)-4-(3,5-Diamino-2,4,6-Trihydroxycyclohexyl)Oxy-6-(Hydroxymethyl)Spiro[4,6,7,7a-Tetrahydro-3aH-[1,3]Dioxolo[4,5-d]Pyran-2,2'-Oxane]-3',4',5',7-Tetrol
[CAS# 39471-55-1]

Identification

• Name: 6'-(1-Amino-2-Hydroxyethyl)-4-(3,5-Diamino-2,4,6-Trihydroxycyclohexyl)Oxy-6-(Hydroxymethyl)Spiro[4,6,7,7a-Tetrahydro-3aH-[1,3]Dioxolo[4,5-d]Pyran-2,2'-Oxane]-3',4',5',7-Tetrol
• Synonyms: 6'-(1-Amino-2-Hydroxy-Ethyl)-4-(3,5-Diamino-2,4,6-Trihydroxy-Cyclohexoxy)-6-(Hydroxymethyl)Spiro[4,6,7,7A-Tetrahydro-3Ah-[1,3]Dioxolo[4,5-D]Pyran-2,2'-Tetrahydropyran]-3',4',5',7-Tetrol; 6'-(1-Amino-2-Hydroxyethyl)-4-(3,5-Diamino-2,4,6-Trihydroxycyclohexoxy)-6-(Hydroxymethyl)Spiro[4,6,7,7A-Tetrahydro-3Ah-[1,3]Dioxolo[4,5-D]Pyran-2,2'-Tetrahydropyran]-3',4',5',7-Tetrol; 6'-(1-Amino-2-Hydroxy-Ethyl)-4-(3,5-Diamino-2,4,6-Trihydroxy-Cyclohexoxy)-6-Methylol-Spiro[4,6,7,7A-Tetrahydro-3Ah-[1,3]Dioxolo[4,5-D]Pyran-2,2'-Tetrahydropyran]-3',4',5',7-Tetrol
• Molecular Formula: C₁₉H₃₅N₃O₁₄
• Molecular Weight: 529.50
• CAS Registry Number: 39471-55-1
• SMILES: C(C3C(C1OC4(OC1C(OC2C(C(C(O)C(C2O)N)N)O)O3)OC(C(O)C(C4O)O)C(N)CO)O)O
• InChI: 1S/C19H35N3O14/c20-3(1-23)13-11(29)12(30)17(31)19(34-13)35-15-7(25)4(2-24)32-18(16(15)36-19)33-14-9(27)5(21)8(26)6(22)10(14)28/h3-18,23-31H,1-2,20-22H2
• InChIKey: XILKGRFKVHSHRS-UHFFFAOYSA-N

Properties

• Density: 1.808g/cm³ (Cal.)
• Boiling point: 953.821°C at 760 mmHg (Cal.)
• Flash point: 530.652°C (Cal.)