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Cichopumilide
ScientificNameLabel
Cichopumilide
PHCD compound ID :
4048
Chemical Names :
Cichopumilide
Molecular Formula :
C15H20O2
Molecular Weight :
232.14633
More Details :
Names & Synonyms:
Smiles:
C[C@@H]1CC[C@@H]2[C@H](C3=C(CC[C@@H]13)C)OC(=O)C2=C
InChi :
InChI=1S/C15H20O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h8,11-12,14H,3-7H2,1-2H3/t8-,11+,12+,14-/m1/s1
InChi Key :
InChIKey=JYYNSFOOPDMSTI-BHGAFXIHSA-N
PubChem ID :
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
2
Ionization potential :
9.087106
Hydrogen bond donor count :
0
Electric dipole moment :
4.723
XLogP :
3.042
VDW volume :
240.597929
Molecular weight :
232.14633
HOMO-LUMO gap :
8.943000
Herb list :
Chicory, Succory - Cichorium intybus - کاسنی
Refrences & Litretures:
559. Journal:'Evidence-Based Complementary and Alternative Medicine' Year:'2013' Volume:'' Page:'579319' DOI:'10.1155/2013/579319' Title:'Cichorium intybus: Traditional Uses, Phytochemistry, Pharmacology, and Toxicology'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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