Schisantherin D
[CAS# 64917-82-4]

Identification

• Name: Schisantherin D
• Molecular Formula: C₂₉H₂₈O₉
• Molecular Weight: 520.53
• CAS Registry Number: 64917-82-4
• SMILES: [C@@H]3(C4=C(C1=C(C=C2C(=C1OC)OCO2)C[C@@H]([C@@]3(O)C)C)C(=C5C(=C4)OCO5)OC)OC(=O)C6=CC=CC=C6
• InChI: 1S/C29H28O9/c1-15-10-17-11-19-23(36-13-34-19)25(32-3)21(17)22-18(12-20-24(26(22)33-4)37-14-35-20)27(29(15,2)31)38-28(30)16-8-6-5-7-9-16/h5-9,11-12,15,27,31H,10,13-14H2,1-4H3/t15-,27-,29-/m0/s1
• InChIKey: PGEJVRVFUGSAJF-SSEZWIOCSA-N

Properties

• Density: 1.421g/cm³ (Cal.)
• Boiling point: 675.709°C at 760 mmHg (Cal.)
• Flash point: 223.681°C (Cal.)