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(+)-Gymnomitrene
ScientificNameLabel
(+)-Gymnomitrene
PHCD compound ID :
1219
Chemical Names :
(+)-Gymnomitrene , (-)-Gymnomitrene
Molecular Formula :
C15H24
Molecular Weight :
204.187801
More Details :
Names & Synonyms:
Smiles:
C=C1CC[C@@]2(C[C@H]1[C@@]1(C)CCC[C@@]21C)C
InChi :
InChI=1S/C15H24/c1-11-6-9-13(2)10-12(11)14(3)7-5-8-15(13,14)4/h12H,1,5-10H2,2-4H3/t12-,13-,14-,15+/m1/s1
InChi Key :
InChIKey=RTONMYLSQISFQA-TUVASFSCSA-N
PubChem ID :
524194
Rotatable bond count :
0
Rule of five :
1
Hydrogen bond acceptor count :
0
Ionization potential :
9.490792
Hydrogen bond donor count :
0
Electric dipole moment :
1.080
XLogP :
6.74
VDW volume :
228.290393
Molecular weight :
204.187801
HOMO-LUMO gap :
10.854000
Herb list :
Galbanum - Ferula gummosa - باريجه، قاسنی
Refrences & Litretures:
125. Journal:'Chemistry of Natural Compounds' Year:'2008' Volume:'44' Page:'124' DOI:'' Title:'STUDY OF THE ESSENTIAL OIL VARIATION OF Ferula gummosa SAMPLES FROM IRAN'
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