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ScientificNameLabel
Chelidonine
PHCD compound ID : 3421
Chemical Names :
Chelidonine
Molecular Formula : C20H19N1O5
Molecular Weight : 353.126323
More Details :
Names & Synonyms:
Smiles: CN1Cc2c([C@@H]3[C@H]1c1cc4OCOc4cc1C[C@@H]3O)ccc1c2OCO1
InChi : InChI=1S/C20H19NO5/c1-21-7-13-11(2-3-15-20(13)26-9-23-15)18-14(22)4-10-5-16-17(25-8-24-16)6-12(10)19(18)21/h2-3,5-6,14,18-19,22H,4,7-9H2,1H3/t14-,18-,19+/m0/s1
InChi Key : InChIKey=GHKISGDRQRSCII-ZOCIIQOWSA-N
PubChem ID : 197810
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 6 Ionization potential : 8.712037
Hydrogen bond donor count : 1 Electric dipole moment : 3.160
XLogP : 0.698 VDW volume : 297.666541
Molecular weight : 353.126323 HOMO-LUMO gap : 8.571000
Herb list :
Refrences & Litretures:
  
477.      Journal:'Planta Medica'      Year:'1985'      Volume:'51'      Page:'319'      DOI:''      Title:'Separation and Quantification of Some Alkaloids from Fumaria parviflora by Capillary Isotachophoresis'
819.      Journal:'Chemistry and Ecology'      Year:'2018'      Volume:'34'      Page:'582'      DOI:'10.1080/02757540.2018.1462345'      Title:'Chemical composition and antifungal activity of Chelidonium majus extracts – antagonistic action of chelerythrine and sanguinarine against Botrytis cinerea'
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