Skip Navigation Links
ScientificNameLabel
Viridiflorence
PHCD compound ID : 958
Chemical Names :
Viridiflorence
Molecular Formula : C15H27N1O4
Molecular Weight : 285.194008
More Details :
Names & Synonyms: [(1R,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (2S)-2-hydroxy-2-[(1S)-1-hydroxyethyl]-3-methyl-butanoate , (2S)-2-hydroxy-2-[(1S)-1-hydroxyethyl]-3-methylbutanoic acid [(1R,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl ester , [(1R,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (2S)-2-hydroxy-2-[(1S)-1-hydroxyethyl]-3-methylbutanoate , [(1R,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (2S)-3-methyl-2-oxidanyl-2-[(1S)-1-oxidanylethyl]butanoate , (2S)-2-hydroxy-2-[(1S)-1-hydroxyethyl]-3-methyl-butyric acid [(1R,8S)-pyrrolizidin-1-yl]methyl ester
Smiles: CC([C@@](C(=O)OC[C@@H]1CCN2[C@H]1CCC2)([C@@H](O)C)O)C
InChi : InChI=1S/C15H27NO4/c1-10(2)15(19,11(3)17)14(18)20-9-12-6-8-16-7-4-5-13(12)16/h10-13,17,19H,4-9H2,1-3H3/t11-,12-,13-,15-/m0/s1
InChi Key : InChIKey=BWQSLRZZOVFVHJ-ABHRYQDASA-N
PubChem ID : 6453144
Rotatable bond count : 6 Rule of five : 0
Hydrogen bond acceptor count : 5 Ionization potential : 8.848722
Hydrogen bond donor count : 2 Electric dipole moment : 2.865
XLogP : 0.599 VDW volume : 286.804519
Molecular weight : 285.194008 HOMO-LUMO gap : 9.638000
Herb list :
Refrences & Litretures:
  
84.      Journal:'European Journal of Experimental Biology'      Year:'2014'      Volume:'4'      Page:'253'      DOI:''      Title:'Chemical composition and insecticidal activity of essential oil of Zataria multiflora Boiss. (Lamiaceae) against Ephestia kuehniella (Lepidoptera: Pyralidae)'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us