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ScientificNameLabel
Amorphan-3en-9-ol
PHCD compound ID : 3932
Chemical Names :
Amorphan-3en-9-ol
Molecular Formula : C15H26O1
Molecular Weight : 222.198365
More Details :
Names & Synonyms: (1R,4S,4aR,8aS)-4-isopropyl-1,6-dimethyl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol , (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
Smiles: CC1=C[C@@H]2[C@H](CC1)[C@](C)(O)CC[C@H]2C(C)C
InChi : InChI=1S/C15H26O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h9-10,12-14,16H,5-8H2,1-4H3/t12-,13-,14-,15+/m0/s1
InChi Key : InChIKey=LHYHMMRYTDARSZ-ZQDZILKHSA-N
PubChem ID : 3084311
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.226448
Hydrogen bond donor count : 1 Electric dipole moment : 2.030
XLogP : 4.476 VDW volume : 249.437079
Molecular weight : 222.198365 HOMO-LUMO gap : 10.553000
Herb list :
Refrences & Litretures:
  
539.      Journal:'J. Med. Plants Res'      Year:'2013'      Volume:'7'      Page:'2349'      DOI:'10.5897/JMPR2013.4493'      Title:'Correlation between chemical profiles of black pepper (Piper nigrum L.) var. Panniyur-1 collected from different locations'
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