Picrasin A
[CAS# 27368-79-2]

Identification

• Name: Picrasin A
• Molecular Formula: C₂₆H₃₄O₈
• Molecular Weight: 474.55
• CAS Registry Number: 27368-79-2
• SMILES: [C@@]12([C@H]3[C@@]5([C@@H](C[C@H]1OC(=O)C[C@H]2[C@@](C[C@H]3O)(C(=O)[C@@H]4CC(OC4)=O)C)[C@@H](C=C(OC)C5=O)C)C)C
• InChI: 1S/C26H34O8/c1-12-6-16(32-5)23(31)25(3)14(12)8-18-26(4)17(9-20(29)34-18)24(2,10-15(27)21(25)26)22(30)13-7-19(28)33-11-13/h6,12-15,17-18,21,27H,7-11H2,1-5H3/t12-,13-,14+,15-,17+,18-,21-,24-,25+,26-/m1/s1
• InChIKey: BIJFTRIMTHYJOV-QRWZCSJESA-N

Properties

• Density: 1.31g/cm³ (Cal.)
• Boiling point: 701.845°C at 760 mmHg (Cal.)
• Flash point: 236.53°C (Cal.)