Methyl (2S,3S,4S)-3-(Hydroxymethyl)-2-Methyl-4-[(9-Methyl-9H-beta-Carbolin-1-Yl)Methyl]-3,4-Dihydro-2H-Pyran-5-Carboxylate
[CAS# 25394-75-6]

Identification

• Name: Methyl (2S,3S,4S)-3-(Hydroxymethyl)-2-Methyl-4-[(9-Methyl-9H-beta-Carbolin-1-Yl)Methyl]-3,4-Dihydro-2H-Pyran-5-Carboxylate
• Molecular Formula: C₂₂H₂₄N₂O₄
• Molecular Weight: 380.44
• CAS Registry Number: 25394-75-6
• SMILES: C[C@H]1[C@@H]([C@@H](C(=CO1)C(=O)OC)CC2=NC=CC3=C2N(C4=CC=CC=C34)C)CO
• InChI: 1S/C22H24N2O4/c1-13-17(11-25)16(18(12-28-13)22(26)27-3)10-19-21-15(8-9-23-19)14-6-4-5-7-20(14)24(21)2/h4-9,12-13,16-17,25H,10-11H2,1-3H3/t13-,16-,17-/m0/s1
• InChIKey: ZHSWZGYEMVSUSM-JQFCIGGWSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 515.7±50.0°C at 760 mmHg (Cal.)
• Flash point: 265.7±30.1°C (Cal.)
• Refractive index: 1.633 (Cal.)