Mitraphyllic Acid
[CAS# 10126-00-8]

Identification

• Name: Mitraphyllic Acid
• Synonyms: (1S,4As,5As,6R,10Ar)-1-Methyl-2'-Oxo-Spiro[1,4A,5,5A,7,8,10,10A-Octahydropyrano[5,4-F]Indolizine-6,3'-Indoline]-4-Carboxylic Acid; (1S,4As,5As,6R,10Ar)-1-Methyl-2'-Oxo-4-Spiro[1,4A,5,5A,7,8,10,10A-Octahydropyrano[5,4-F]Indolizine-6,3'-Indoline]Carboxylic Acid; (1S,4As,5As,6R,10Ar)-2'-Keto-1-Methyl-Spiro[1,4A,5,5A,7,8,10,10A-Octahydropyrano[5,4-F]Indolizine-6,3'-Indoline]-4-Carboxylic Acid
• Molecular Formula: C₂₀H₂₂N₂O₄
• Molecular Weight: 354.40
• CAS Registry Number: 10126-00-8
• SMILES: [C@@]15(C(NC2=C1C=CC=C2)=O)[C@H]4N(C[C@H]3[C@@H](C(=CO[C@H]3C)C(=O)O)C4)CC5
• InChI: 1S/C20H22N2O4/c1-11-13-9-22-7-6-20(15-4-2-3-5-16(15)21-19(20)25)17(22)8-12(13)14(10-26-11)18(23)24/h2-5,10-13,17H,6-9H2,1H3,(H,21,25)(H,23,24)/t11-,12-,13+,17-,20+/m0/s1
• InChIKey: BLXUPISDXRFTCK-GALDEACFSA-N

Properties

• Density: 1.412g/cm³ (Cal.)
• Boiling point: 585.936°C at 760 mmHg (Cal.)
• Flash point: 308.163°C (Cal.)