Carapanaubine
[CAS# 1255-02-3]

Identification

• Name: Carapanaubine
• Synonyms: Methyl (1S,4As,5As,6R,10As)-5',6'-Dimethoxy-1-Methyl-2'-Oxo-Spiro[1,4A,5,5A,7,8,10,10A-Octahydropyrano[5,4-F]Indolizine-6,3'-Indoline]-4-Carboxylate; (1S,4As,5As,6R,10As)-5',6'-Dimethoxy-1-Methyl-2'-Oxo-4-Spiro[1,4A,5,5A,7,8,10,10A-Octahydropyrano[5,4-F]Indolizine-6,3'-Indoline]Carboxylic Acid Methyl Ester; (1S,4As,5As,6R,10As)-2'-Keto-5',6'-Dimethoxy-1-Methyl-Spiro[1,4A,5,5A,7,8,10,10A-Octahydropyrano[5,4-F]Indolizine-6,3'-Indoline]-4-Carboxylic Acid Methyl Ester
• Molecular Formula: C₂₃H₂₈N₂O₆
• Molecular Weight: 428.48
• CAS Registry Number: 1255-02-3
• SMILES: [C@@]15(C(NC2=C1C=C(C(=C2)OC)OC)=O)[C@H]4N(C[C@@H]3[C@@H](C(=CO[C@H]3C)C(=O)OC)C4)CC5
• InChI: 1S/C23H28N2O6/c1-12-14-10-25-6-5-23(20(25)7-13(14)15(11-31-12)21(26)30-4)16-8-18(28-2)19(29-3)9-17(16)24-22(23)27/h8-9,11-14,20H,5-7,10H2,1-4H3,(H,24,27)/t12-,13-,14-,20-,23+/m0/s1
• InChIKey: QIZNWMMOECVGAP-GHTUMPRVSA-N

Properties

• Density: 1.342g/cm³ (Cal.)
• Boiling point: 599.535°C at 760 mmHg (Cal.)
• Flash point: 316.388°C (Cal.)