Isocodonocarpine

ScientificNameLabel

Isocodonocarpine
PHCD compound ID :	5146
Chemical Names :	Isocodonocarpine
Molecular Formula :	C26H31N3O5
Molecular Weight :	465.226371

More Details :

Names & Synonyms:
Smiles:	COc1ccc2cc1Oc1ccc(cc1O)/C=C\C(=O)NCCCCNCCCNC(=O)/C=C/2
InChi :	InChI=1S/C26H31N3O5/c1-33-23-10-6-20-8-12-26(32)29-16-4-14-27-13-2-3-15-28-25(31)11-7-19-5-9-22(21(30)17-19)34-24(23)18-20/h5-12,17-18,27,30H,2-4,13-16H2,1H3,(H,28,31)(H,29,32)/b11-7+,12-8+
InChi Key :	InChIKey=KPNGFGNUYCYQMH-MKICQXMISA-N
PubChem ID :

Rotatable bond count :	1	Rule of five :	0
Hydrogen bond acceptor count :	8	Ionization potential :	8.941336
Hydrogen bond donor count :	4	Electric dipole moment :	3.298
XLogP :	1.568	VDW volume :	449.95951
Molecular weight :	465.226371	HOMO-LUMO gap :	8.215000

Herb list :

Caper berry, Kureel tree - Capparis decidua - کلیر

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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