[2-[(3S,8S,9S,10R,13S,14S,16R,17S)-3-Hydroxy-10,13,16-Trimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-17-Yl]-2-Oxoethyl] Acetate
[CAS# 1173-09-7]

Identification

• Name: [2-[(3S,8S,9S,10R,13S,14S,16R,17S)-3-Hydroxy-10,13,16-Trimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-17-Yl]-2-Oxoethyl] Acetate
• Synonyms: [2-[(3S,8S,9S,10R,13S,14S,16R,17S)-3-Hydroxy-10,13,16-Trimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Acetate; Acetic Acid [2-[(3S,8S,9S,10R,13S,14S,16R,17S)-3-Hydroxy-10,13,16-Trimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester; Acetic Acid [2-[(3S,8S,9S,10R,13S,14S,16R,17S)-3-Hydroxy-10,13,16-Trimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Ester
• Molecular Formula: C₂₄H₃₆O₄
• Molecular Weight: 388.55
• CAS Registry Number: 1173-09-7
• EINECS: 214-633-7
• SMILES: [C@H]23[C@H]1[C@@]([C@H]([C@@H](C1)C)C(=O)COC(=O)C)(CC[C@@H]2[C@@]4(C(=CC3)C[C@@H](O)CC4)C)C
• InChI: 1S/C24H36O4/c1-14-11-20-18-6-5-16-12-17(26)7-9-23(16,3)19(18)8-10-24(20,4)22(14)21(27)13-28-15(2)25/h5,14,17-20,22,26H,6-13H2,1-4H3/t14-,17+,18-,19+,20+,22-,23+,24+/m1/s1
• InChIKey: LIZWBGZACPSUNY-MDXUQPGDSA-N

Properties

• Density: 1.136g/cm³ (Cal.)
• Boiling point: 506.106°C at 760 mmHg (Cal.)
• Flash point: 166.111°C (Cal.)