N-Formyljervine
[CAS# 66409-98-1]

Identification

• Name: N-Formyljervine
• Synonyms: (3'As,7'Ar,9R)-3-Hydroxy-3',6',10,11B-Tetramethyl-11-Oxo-Spiro[1,2,3,4,6,6A,6B,7,8,11A-Decahydrobenzo[I]Fluorene-9,2'-3,3A,5,6,7,7A-Hexahydrofuro[4,5-B]Pyridine]-4'-Carbaldehyde; (3'As,7'Ar,9R)-3-Hydroxy-3',6',10,11B-Tetramethyl-11-Oxo-4'-Spiro[1,2,3,4,6,6A,6B,7,8,11A-Decahydrobenzo[I]Fluorene-9,2'-3,3A,5,6,7,7A-Hexahydrofuro[4,5-B]Pyridine]Carboxaldehyde; (3'As,7'Ar,9R)-3-Hydroxy-11-Keto-3',6',10,11B-Tetramethyl-Spiro[1,2,3,4,6,6A,6B,7,8,11A-Decahydrobenzo[I]Fluorene-9,2'-3,3A,5,6,7,7A-Hexahydrofuro[4,5-B]Pyridine]-4'-Carbaldehyde
• Molecular Formula: C₂₈H₃₉NO₄
• Molecular Weight: 453.62
• CAS Registry Number: 66409-98-1
• SMILES: [C@@]26(O[C@H]1[C@@H](N(CC(C1)C)C=O)C2C)C(=C3C(C4C(C3=O)C5(C(=CC4)CC(O)CC5)C)CC6)C
• InChI: 1S/C28H39NO4/c1-15-11-22-25(29(13-15)14-30)17(3)28(33-22)10-8-20-21-6-5-18-12-19(31)7-9-27(18,4)24(21)26(32)23(20)16(28)2/h5,14-15,17,19-22,24-25,31H,6-13H2,1-4H3/t15?,17?,19?,20?,21?,22-,24?,25+,27?,28+/m1/s1
• InChIKey: WAULJAUXPVUQMT-HXQQKEKESA-N

Properties

• Density: 1.227g/cm³ (Cal.)
• Boiling point: 649.987°C at 760 mmHg (Cal.)
• Flash point: 346.9°C (Cal.)