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ScientificNameLabel
(+)-trans-Chrysanthemic acid
PHCD compound ID : 2974
Chemical Names :
(+)-trans-Chrysanthemic acid
Molecular Formula : C10H16O2
Molecular Weight : 168.11503
More Details :
Names & Synonyms: (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylic acid , (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxylic acid , (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylic acid
Smiles: CC(=C[C@@H]1[C@H](C1(C)C)C(=O)O)C
InChi : InChI=1S/C10H16O2/c1-6(2)5-7-8(9(11)12)10(7,3)4/h5,7-8H,1-4H3,(H,11,12)/t7-,8+/m1/s1
InChi Key : InChIKey=XLOPRKKSAJMMEW-SFYZADRCSA-N
PubChem ID : 16747
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.440625
Hydrogen bond donor count : 1 Electric dipole moment : 2.668
XLogP : 2.533 VDW volume : 181.467382
Molecular weight : 168.11503 HOMO-LUMO gap : 10.268000
Herb list :
Refrences & Litretures:
  
377.      Journal:'Pharmaceutical Biology'      Year:'2011'      Volume:'49'      Page:'756'      DOI:'10.3109/13880209.2010.547206'      Title:'Chemical constituents and bioactivities of the liposoluble fraction from different medicinal parts of Crocus sativus'
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