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Portulacanones B
ScientificNameLabel
Portulacanones B
PHCD compound ID :
2636
Chemical Names :
Portulacanones B
Molecular Formula :
C19H20O6
Molecular Weight :
344.125988
More Details :
Names & Synonyms:
Smiles:
COc1c2c(OC[C@@H](C2=O)Cc2ccccc2O)cc(c1OC)OC
InChi :
InChI=1S/C19H20O6/c1-22-15-9-14-16(19(24-3)18(15)23-2)17(21)12(10-25-14)8-11-6-4-5-7-13(11)20/h4-7,9,12,20H,8,10H2,1-3H3/t12-/m0/s1
InChi Key :
InChIKey=ZSXUWWSHEFZEIN-LBPRGKRZSA-N
PubChem ID :
Rotatable bond count :
5
Rule of five :
0
Hydrogen bond acceptor count :
6
Ionization potential :
8.877933
Hydrogen bond donor count :
1
Electric dipole moment :
1.114
XLogP :
1.808
VDW volume :
312.59694
Molecular weight :
344.125988
HOMO-LUMO gap :
8.563000
Herb list :
Common purslane - Portulaca oleracea - خرفه
Refrences & Litretures:
309. Journal:'BioMed Research International' Year:'2015' Volume:'' Page:'925631' DOI:'10.1155/2015/925631' Title:'Portulaca oleracea L.: A Review of Phytochemistry and Pharmacological Effects'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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