(12xi,13xi)-14,19-Dihydro-12,13-Dihydroxy-14-Methylcrotalanan-11,15-Dione
[CAS# 53937-97-6]

Identification

• Name: (12xi,13xi)-14,19-Dihydro-12,13-Dihydroxy-14-Methylcrotalanan-11,15-Dione
• Molecular Formula: C₁₈H₂₇NO₆
• Molecular Weight: 353.41
• CAS Registry Number: 53937-97-6
• SMILES: [C@H]12C3=CCN1CCC2OC(C(C(C(C(OC3)=O)(O)C)(O)C)(CC)C)=O
• InChI: 1S/C18H27NO6/c1-5-16(2)14(20)25-12-7-9-19-8-6-11(13(12)19)10-24-15(21)17(3,22)18(16,4)23/h6,12-13,22-23H,5,7-10H2,1-4H3/t12?,13-,16?,17?,18?/m1/s1
• InChIKey: UWVWNXIKNRJZDC-VKYMYMNISA-N

Properties

• Density: 1.302g/cm³ (Cal.)
• Boiling point: 540.374°C at 760 mmHg (Cal.)
• Flash point: 280.608°C (Cal.)