Celapanine
[CAS# 52658-32-9]

Identification

• Name: Celapanine
• Synonyms: C09937
• Molecular Formula: C₃₀H₃₅NO₁₀
• Molecular Weight: 569.61
• CAS Registry Number: 52658-32-9
• SMILES: [C@@]145OC([C@@H]([C@H]1OC(=O)C2=COC=C2)[C@@H](OC(=O)C)[C@H](OC(=O)C3=CN=CC=C3)[C@@]4([C@@H](OC(=O)C)CCC5C)C)(C)C
• InChI: 1S/C30H35NO10/c1-16-9-10-21(37-17(2)32)29(6)25(40-26(34)19-8-7-12-31-14-19)23(38-18(3)33)22-24(30(16,29)41-28(22,4)5)39-27(35)20-11-13-36-15-20/h7-8,11-16,21-25H,9-10H2,1-6H3/t16?,21-,22+,23+,24+,25-,29-,30+/m0/s1
• InChIKey: MHXMEJIEIHJTGN-GTTNOKDOSA-N

Properties

• Density: 1.318g/cm³ (Cal.)
• Boiling point: 624.752°C at 760 mmHg (Cal.)
• Flash point: 331.638°C (Cal.)