96291-82-6 (((-)-9-O-viridiflorylheliotridine)

CAS号:
96291-82-6
英文名称:
(-)-9-O-viridiflorylheliotridine
分子式:
C15H25NO5
分子量:
299.362704992294

(-)-9-O-viridiflorylheliotridine(96291-82-6)名称与标识符

名称

英文别名:
(-)-9-O-viridiflorylheliotridine;(+)-Echinatine;(2S,3S)-2,3-Dihydroxy-2-isopropyl-buttersaeure-((7aR)-7c-h;(2S,3S)-2,3-dihydroxy-2-isopropyl-butyric acid-((7aR)-7c-hydroxy-(7ar)-5,6,7,7a-tetrahydro-3H-pyrrolizin-1-ylmethyl ester);Echinantin;Echinatin;echinatine;Indicin;lycopsamine;SFVVQRJOGUKCEG-OPQSFPLASA-N;Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, [(1R,7aR)-2,3,5,7a-tetrahydro-1-hydroxy-1H-pyrrolizin-7-yl]methyl ester, (2S,3R)-rel-;

标识符

InChIKey:
SFVVQRJOGUKCEG-OPQSFPLASA-N
Inchi:
1S/C15H25NO5/c1-9(2)15(20,10(3)17)14(19)21-8-11-4-6-16-7-5-12(18)13(11)16/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3/t10-,12-,13-,15+/m1/s1
SMILES:
C(OCC1[C@]2([H])[C@H](O)CCN2CC=1)(=O)[C@](O)(C(C)C)[C@H](O)C

(-)-9-O-viridiflorylheliotridine(96291-82-6)物化性质

实验特性

  • 沸点 : 463.3±45.0 °C(Predicted)
  • 酸度系数(pKa) : 12.59±0.29(Predicted)
  • 密度 : 1.26±0.1 g/cm3(Predicted)