Dysobinin
[CAS# 62655-03-2]

Identification

• Name: Dysobinin
• Synonyms: [(5R,6S,7S,9R,10R,13S,17R)-6-Acetoxy-17-(3-Furyl)-4,4,8,10,13-Pentamethyl-3-Oxo-5,6,7,9,11,12,16,17-Octahydrocyclopenta[A]Phenanthren-7-Yl] Acetate; Acetic Acid [(5R,6S,7S,9R,10R,13S,17R)-6-Acetoxy-17-(3-Furyl)-4,4,8,10,13-Pentamethyl-3-Oxo-5,6,7,9,11,12,16,17-Octahydrocyclopenta[A]Phenanthren-7-Yl] Ester; Acetic Acid [(5R,6S,7S,9R,10R,13S,17R)-6-Acetoxy-17-(3-Furyl)-3-Keto-4,4,8,10,13-Pentamethyl-5,6,7,9,11,12,16,17-Octahydrocyclopenta[A]Phenanthren-7-Yl] Ester
• Molecular Formula: C₃₀H₃₈O₆
• Molecular Weight: 494.63
• CAS Registry Number: 62655-03-2
• SMILES: [C@@H]13[C@@]5([C@@H]([C@H](OC(=O)C)[C@@H](OC(=O)C)C1(C2=CC[C@H]([C@@]2(CC3)C)C4=COC=C4)C)C(C(=O)C=C5)(C)C)C
• InChI: 1S/C30H38O6/c1-17(31)35-24-25-27(3,4)23(33)11-14-29(25,6)22-10-13-28(5)20(19-12-15-34-16-19)8-9-21(28)30(22,7)26(24)36-18(2)32/h9,11-12,14-16,20,22,24-26H,8,10,13H2,1-7H3/t20-,22+,24-,25-,26+,28-,29+,30?/m0/s1
• InChIKey: VFSQXYZMHUBVJU-LFLARYETSA-N

Properties

• Density: 1.194g/cm³ (Cal.)
• Boiling point: 549.521°C at 760 mmHg (Cal.)
• Flash point: 286.14°C (Cal.)