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ScientificNameLabel
Linoleylhydroxamate I
PHCD compound ID : 3261
Chemical Names :
Linoleylhydroxamate I , Linoleylhydroxamate II
Molecular Formula : C18H33N1O2
Molecular Weight : 295.251129
More Details :
Names & Synonyms: (9E,12E)-octadeca-9,12-dienehydroxamic acid , (9E,12E)-N-hydroxyoctadeca-9,12-dienamide , (9E,12E)-N-oxidanyloctadeca-9,12-dienamide
Smiles: CCCCC/C=C/C/C=C/CCCCCCCC(=O)NO
InChi : InChI=1S/C18H33NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19-21/h6-7,9-10,21H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6+,10-9+
InChi Key : InChIKey=ICBBTPIZRNITQC-AVQMFFATSA-N
PubChem ID : 20342693
Rotatable bond count : 15 Rule of five : 2
Hydrogen bond acceptor count : 1 Ionization potential : 9.465319
Hydrogen bond donor count : 2 Electric dipole moment : 2.655
XLogP : 7.217 VDW volume : 340.552019
Molecular weight : 295.251129 HOMO-LUMO gap : 10.241000
Herb list :
Refrences & Litretures:
  
443.      Journal:'Food Chemistry'      Year:'2015'      Volume:'166'      Page:'179'      DOI:'10.1016/j.foodchem.2014.06.011'      Title:'HPLC–DAD–ESI-MS/MS screening of bioactive components from Rhus coriaria L. (Sumac) fruits'
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