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ScientificNameLabel
Thionol
PHCD compound ID : 794
Chemical Names :
Thionol
Molecular Formula : C12H7N1O2S1
Molecular Weight : 229.019749
More Details :
Names & Synonyms: 7-hydroxyphenothiazin-3-one , 7-hydroxy-3-phenothiazinone , 7-oxidanylphenothiazin-3-one
Smiles: Oc1ccc2c(c1)sc1c(n2)ccc(=O)c1
InChi : InChI=1S/C12H7NO2S/c14-7-1-3-9-11(5-7)16-12-6-8(15)2-4-10(12)13-9/h1-6,14H
InChi Key : InChIKey=GSEOMGSFLQCKRO-UHFFFAOYSA-N
PubChem ID : 411278
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 8.753521
Hydrogen bond donor count : 1 Electric dipole moment : 4.274
XLogP : 0.551 VDW volume : 196.769925
Molecular weight : 229.019749 HOMO-LUMO gap : 6.769000
Herb list :
Refrences & Litretures:
  
55.      Journal:'Food Chemistry'      Year:'2013'      Volume:'138'      Page:'2180'      DOI:'10.1016/j.foodchem.2012.11.131'      Title:'Chemical composition, antioxidant and antimicrobial activities of essential oil obtained from Ferula assa-foetida oleo-gum-resin: Effect of collection time'
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