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ScientificNameLabel
Cholest-5-en-7-ol
PHCD compound ID : 1133
Chemical Names :
Cholest-5-en-7-ol
Molecular Formula : C27H46O1
Molecular Weight : 386.354866
More Details :
Names & Synonyms:
Smiles: CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2[C@H](O)C=C2[C@]1(C)CCCC2)C)C
InChi : InChI=1S/C27H46O/c1-18(2)9-8-10-19(3)21-12-13-22-25-23(14-16-27(21,22)5)26(4)15-7-6-11-20(26)17-24(25)28/h17-19,21-25,28H,6-16H2,1-5H3/t19-,21-,22+,23+,24-,25+,26+,27-/m1/s1
InChi Key : InChIKey=KZZKTKXOBANOSK-JDFHDHJPSA-N
PubChem ID :
Rotatable bond count : 5 Rule of five : 1
Hydrogen bond acceptor count : 1 Ionization potential : 9.403738
Hydrogen bond donor count : 1 Electric dipole moment : 2.134
XLogP : 10.573 VDW volume : 432.275977
Molecular weight : 386.354866 HOMO-LUMO gap : 10.594000
Herb list :
Refrences & Litretures:
  
115.      Journal:'Asian Pac J Trop Biomed'      Year:'2015'      Volume:'5'      Page:'458'      DOI:''      Title:'Phytochemistry of the essential oil of Melissa officinalis L. growing wild in Morocco: Preventive approach against nosocomial infections'
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