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Compound: 5546
Plants: 312
References: 992
Visitors: 46
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Cedrenol
ScientificNameLabel
Cedrenol
PHCD compound ID :
4656
Chemical Names :
Cedrenol
Molecular Formula :
C15H24O1
Molecular Weight :
220.182715
More Details :
Names & Synonyms:
Smiles:
O[C@H]1C[C@]23C[C@@H](C1=C)C([C@@H]3CC[C@H]2C)(C)C
InChi :
InChI=1S/C15H24O/c1-9-5-6-13-14(3,4)11-7-15(9,13)8-12(16)10(11)2/h9,11-13,16H,2,5-8H2,1,3-4H3/t9-,11+,12+,13+,15-/m1/s1
InChi Key :
InChIKey=DJYWGTBEZVORGE-DYTIKBOPSA-N
PubChem ID :
21119906
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.537756
Hydrogen bond donor count :
1
Electric dipole moment :
2.380
XLogP :
4.612
VDW volume :
237.08062
Molecular weight :
220.182715
HOMO-LUMO gap :
10.834000
Herb list :
Carrot - Daucus carota - هویج
Foxglove - Digitalis nervosa Steud & Hochst - گل انگشتانه
Refrences & Litretures:
735. Journal:'J. Mater. Environ. Sci' Year:'2015' Volume:'6' Page:'784' DOI:'' Title:'Chemical composition and antioxidant activity of the essential oil and the methanol extract of Algerian wild carrot Daucus carota L. ssp. carota. (L.) Thell'
839. Journal:'Russian Chemical Bulletin, International Edition' Year:'2016' Volume:'65' Page:'1148' DOI:'10.1007/s11172-016-1428-6' Title:'The volatile constituent analysis of Digitalis nervosa Steud. & Hochst. ex Benth. from Iran'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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