Cucurbitacin Q1
[CAS# 99530-82-2]

Identification

• Name: Cucurbitacin Q1
• Synonyms: [(E,6R)-6-hydroxy-2-methyl-5-oxo-6-[(2S,3S,8S,9R,10R,13R,14S,16R,17R)-2,3,16-trihydroxy-4,4,9,13,14-pentamethyl-11-oxo-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]hept-3-en-2-yl] acetate
• Molecular Formula: C₃₂H₄₈O₈
• Molecular Weight: 560.72
• CAS Registry Number: 99530-82-2
• SMILES: CC(=O)OC(C)(C)/C=C/C(=O)[C@@](C)([C@H]1[C@@H](C[C@@]2([C@@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C[C@@H]([C@H](C4(C)C)O)O)C)C)C)O)O

Properties

• Density: 1.2±0.1 g/cm³, Calc.^*
• Index of Refraction: 1.573, Calc.^*
• Boiling Point: 685.8±55.0 ºC (760 mmHg), Calc.^*
• Flash Point: 213.0±25.0 ºC, Calc.^*

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software.