[14-Hydroxy-10,13-Dimethyl-17-(5-Oxo-2H-Furan-3-Yl)-1,2,3,4,5,6,7,8,9, 11,12,15,16,17-Tetradecahydrocyclopenta[a]Phenanthren-3-Yl] 2-(2,3,4,5 -Tetrahydroxyhexylideneamino)Propanoate
[CAS# 81072-30-2]

Identification

• Name: [14-Hydroxy-10,13-Dimethyl-17-(5-Oxo-2H-Furan-3-Yl)-1,2,3,4,5,6,7,8,9, 11,12,15,16,17-Tetradecahydrocyclopenta[a]Phenanthren-3-Yl] 2-(2,3,4,5 -Tetrahydroxyhexylideneamino)Propanoate
• Synonyms: 2-(2,3,4,5-Tetrahydroxyhexylideneamino)Propanoic Acid [14-Hydroxy-10,13-Dimethyl-17-(5-Oxo-2H-Furan-3-Yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-3-Yl] Ester; 2-(2,3,4,5-Tetrahydroxyhexylideneamino)Propionic Acid [14-Hydroxy-17-(5-Keto-2H-Furan-3-Yl)-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-3-Yl] Ester; Alanine, N-(6-Deoxy-L-Mannosyl)-, 3-Ester With 3-Beta,14-Dihydroxy-5-Beta-Card-20(22)-Enolide, D-
• Molecular Formula: C₃₂H₄₉NO₉
• Molecular Weight: 591.74
• CAS Registry Number: 81072-30-2 (81176-34-3)
• SMILES: CC34C(O)(C1C(C2(C(CC1)CC(OC(=O)C(N=CC(O)C(O)C(O)C(O)C)C)CC2)C)CC3)CCC4C5=CC(OC5)=O
• InChI: 1S/C32H49NO9/c1-17(33-15-25(35)28(38)27(37)18(2)34)29(39)42-21-7-10-30(3)20(14-21)5-6-24-23(30)8-11-31(4)22(9-12-32(24,31)40)19-13-26(36)41-16-19/h13,15,17-18,20-25,27-28,34-35,37-38,40H,5-12,14,16H2,1-4H3
• InChIKey: ONLWCNPBMWHHCU-UHFFFAOYSA-N

Properties

• Density: 1.424g/cm³ (Cal.)
• Boiling point: 802.371°C at 760 mmHg (Cal.)
• Flash point: 439.058°C (Cal.)