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ipsenol
ScientificNameLabel
ipsenol
PHCD compound ID :
525
Chemical Names :
ipsenol
Molecular Formula :
C10H18O1
Molecular Weight :
154.135765
More Details :
Names & Synonyms:
(4S)-2-methyl-6-methylene-oct-7-en-4-ol , (4S)-2-methyl-6-methylene-7-octen-4-ol , (4S)-2-methyl-6-methylideneoct-7-en-4-ol , (4S)-2-methyl-6-methylidene-oct-7-en-4-ol
Smiles:
C=CC(=C)C[C@H](CC(C)C)O
InChi :
InChI=1S/C10H18O/c1-5-9(4)7-10(11)6-8(2)3/h5,8,10-11H,1,4,6-7H2,2-3H3/t10-/m0/s1
InChi Key :
InChIKey=RHAXCOKCIAVHPB-JTQLQIEISA-N
PubChem ID :
93186
Rotatable bond count :
5
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.507161
Hydrogen bond donor count :
1
Electric dipole moment :
1.929
XLogP :
2.942
VDW volume :
185.033614
Molecular weight :
154.135765
HOMO-LUMO gap :
9.993000
Herb list :
Roman nettle, Burning nettle - Urtica pilulifera - انجره، گرنه توپی، گزنه رومی
Refrences & Litretures:
31. Journal:'Global Journal of Pharmacology' Year:'2013' Volume:'7' Page:'377' DOI:'10.5829/idosi.gjp.2013.7.4.1114' Title:'Steryl Glycosides, Lipoidal Matter and Volatile Constituents of Urtica pilulifera'
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