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ScientificNameLabel
Codonocarpine
PHCD compound ID : 5152
Chemical Names :
14-N-acetylcodonocarpine , Codonocarpine
Molecular Formula : C28H33N3O6
Molecular Weight : 507.236936
More Details :
Names & Synonyms:
Smiles: COc1ccc2cc1Oc1ccc(cc1O)/C=C/C(=O)NCCCCN(CCCNC(=O)/C=C/2)C(=O)C
InChi : InChI=1S/C28H33N3O6/c1-20(32)31-16-4-3-14-29-27(34)12-8-21-6-10-24(23(33)18-21)37-26-19-22(7-11-25(26)36-2)9-13-28(35)30-15-5-17-31/h6-13,18-19,33H,3-5,14-17H2,1-2H3,(H,29,34)(H,30,35)/b12-8+,13-9+
InChi Key : InChIKey=WCQJZRNZVUAVEP-QHKWOANTSA-N
PubChem ID :
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 9 Ionization potential : 9.089071
Hydrogen bond donor count : 3 Electric dipole moment : 7.617
XLogP : 1.596 VDW volume : 490.705247
Molecular weight : 507.236936 HOMO-LUMO gap : 8.260000
Herb list :
Refrences & Litretures:
  
818.      Journal:'International Journal of Phytomedicine'      Year:'2010'      Volume:'2'      Page:'10'      DOI:'10.5138/ijpm.2010.0975.0185.02002'      Title:'Phytochemical and pharmacological Potential of Kair (Capparis Decidua)'
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