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ScientificNameLabel
eupha- 7,21-diene
PHCD compound ID : 5642
Chemical Names :
eupha- 7,21-diene
Molecular Formula : C30H50
Molecular Weight : 410.391252
More Details :
Names & Synonyms:
Smiles: CC(=CCC[C@H]([C@H]1CC[C@]2([C@@]1(C)CC[C@H]1C2=CC[C@@H]2[C@]1(C)CCCC2(C)C)C)C)C
InChi : InChI=1S/C30H50/c1-21(2)11-9-12-22(3)23-15-19-30(8)25-13-14-26-27(4,5)17-10-18-28(26,6)24(25)16-20-29(23,30)7/h11,13,22-24,26H,9-10,12,14-20H2,1-8H3/t22-,23-,24+,26+,28-,29+,30-/m1/s1
InChi Key : InChIKey=SZLHPSKURYFPPQ-PUEKBMEESA-N
PubChem ID :
Rotatable bond count : 4 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 8.857726
Hydrogen bond donor count : 0 Electric dipole moment : 0.451
XLogP : 13.462 VDW volume : 472.737245
Molecular weight : 410.391252 HOMO-LUMO gap : 10.282000
Herb list :
Refrences & Litretures:
  
953.      Journal:'European Medicines Agency'      Year:'2008'      Volume:''      Page:''      DOI:''      Title:'ASSESSMENT REPORT ON POLYPODIUM VULGARE L., RHIZOMA'
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