(3beta,5beta,7beta,11beta)-3-((2-Deoxy-beta-D-Arabino-Hexopyranosyl)Oxy)-7,8-Epoxy-11,14-Dihydroxy-12-Oxo-Card-20(22)-Enolide
[CAS# 111420-57-6]

Identification

• Name: (3beta,5beta,7beta,11beta)-3-((2-Deoxy-beta-D-Arabino-Hexopyranosyl)Oxy)-7,8-Epoxy-11,14-Dihydroxy-12-Oxo-Card-20(22)-Enolide
• Synonyms: Cryptosin
• Molecular Formula: C₂₉H₄₀O₁₁
• Molecular Weight: 564.63
• CAS Registry Number: 111420-57-6
• SMILES: [C@@H]1(CC[C@]4([C@@H](C1)C[C@@H]6C5(C3(CC[C@H](C2=CC(OC2)=O)[C@@]3(C)C([C@@H]([C@H]45)O)=O)O)O6)C)O[C@H]7O[C@@H]([C@H]([C@H](O)C7)O)CO
• InChI: 1S/C29H40O11/c1-26-5-3-15(38-21-10-17(31)22(33)18(11-30)39-21)8-14(26)9-19-29(40-19)24(26)23(34)25(35)27(2)16(4-6-28(27,29)36)13-7-20(32)37-12-13/h7,14-19,21-24,30-31,33-34,36H,3-6,8-12H2,1-2H3/t14-,15-,16+,17+,18+,19+,21-,22-,23+,24+,26-,27-,28?,29?/m0/s1
• InChIKey: NRBYBABUHKEQNM-WDVBEFSESA-N

Properties

• Density: 1.5g/cm³ (Cal.)
• Boiling point: 831.877°C at 760 mmHg (Cal.)
• Flash point: 274.503°C (Cal.)