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Norchelerythrine
ScientificNameLabel
Norchelerythrine
PHCD compound ID :
5158
Chemical Names :
Norchelerythrine
Molecular Formula :
C20H15N1O4
Molecular Weight :
333.100108
More Details :
Names & Synonyms:
1,2-dimethoxy-[1,3]benzodioxolo[5,6-c]phenanthridine
Smiles:
COc1c(OC)ccc2c1cnc1c2ccc2c1cc1OCOc1c2
InChi :
InChI=1S/C20H15NO4/c1-22-16-6-5-12-13-4-3-11-7-17-18(25-10-24-17)8-14(11)19(13)21-9-15(12)20(16)23-2/h3-9H,10H2,1-2H3
InChi Key :
InChIKey=JGUNQXPMULKFNY-UHFFFAOYSA-N
PubChem ID :
443719
Rotatable bond count :
2
Rule of five :
0
Hydrogen bond acceptor count :
5
Ionization potential :
8.664022
Hydrogen bond donor count :
0
Electric dipole moment :
1.986
XLogP :
1.951
VDW volume :
271.523396
Molecular weight :
333.100108
HOMO-LUMO gap :
7.569000
Herb list :
Celandine, Swallowwort - Chelidonium majus L - مامیران
Refrences & Litretures:
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'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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