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ScientificNameLabel
Germanicol
PHCD compound ID : 1129
Chemical Names :
Germanicol
Molecular Formula : C30H50O1
Molecular Weight : 426.386166
More Details :
Names & Synonyms: (3S,4aR,6aS,6aR,6bR,8aR,14aR,14bR)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,9,10,13,14,14a-tetradecahydropicen-3-ol
Smiles: O[C@H]1CC[C@]2([C@H](C1(C)C)CC[C@@]1([C@@H]2CC[C@H]2[C@@]1(C)CC[C@@]1(C2=CC(C)(C)CC1)C)C)C
InChi : InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h19-20,22-24,31H,9-18H2,1-8H3/t20-,22+,23-,24+,27-,28+,29-,30-/m1/s1
InChi Key : InChIKey=QMUXVPRGNJLGRT-PNTWTTAKSA-N
PubChem ID : 122857
Rotatable bond count : 0 Rule of five : 1
Hydrogen bond acceptor count : 1 Ionization potential : 9.082183
Hydrogen bond donor count : 1 Electric dipole moment : 2.285
XLogP : 11.348 VDW volume : 471.807472
Molecular weight : 426.386166 HOMO-LUMO gap : 10.517000
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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