5-Ethyltetrahydro-2,3-Dimethyl-6-Oxo-2H-Pyran-2-carboxylic Acid
[CAS# 19776-79-5]

Identification

• Classification: Natural product >> Alkaloid
• Name: 5-Ethyltetrahydro-2,3-Dimethyl-6-Oxo-2H-Pyran-2-carboxylic Acid
• Synonyms: ALPHA-LONGILOBINE; SENECIPHYLLIN; JACODINE
• Molecular Formula: C₁₈H₂₃NO₅
• Molecular Weight: 333.38
• CAS Registry Number: 19776-79-5
• SMILES: C/C=C\1/CC(=C)[C@@](C)(O)C(=O)OCC2=CCN3[C@H]2[C@H](OC1=O)CC3
• InChI: 1S/C18H23NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,14-15,22H,2,6-10H2,1,3H3/b12-4-/t14-,15-,18-/m1/s1