Home
News
Search
Basic
Structure
Physicochemical properties
Topological properties
Services
Virtual Screening
Docking
Chemoinformatics
Training
Help
Data Description
Version History
FAQ
Your Comments
Data Submission
Statistics
Compound: 5546
Plants: 312
References: 992
Visitors: 58
About
About PHCD
The Team
Sponsors
Publications
Citing
Contact Us
Sign in >
Santolina alcohol
ScientificNameLabel
Santolina alcohol
PHCD compound ID :
1427
Chemical Names :
Santolina alcohol
Molecular Formula :
C10H18O1
Molecular Weight :
154.135765
More Details :
Names & Synonyms:
2,5-dimethyl-3-vinyl-hex-4-en-2-ol , 3-ethenyl-2,5-dimethyl-4-hexen-2-ol , 3-ethenyl-2,5-dimethylhex-4-en-2-ol , 3-ethenyl-2,5-dimethyl-hex-4-en-2-ol
Smiles:
C=C[C@H](C(O)(C)C)C=C(C)C
InChi :
InChI=1S/C10H18O/c1-6-9(7-8(2)3)10(4,5)11/h6-7,9,11H,1H2,2-5H3/t9-/m0/s1
InChi Key :
InChIKey=JWGLVEFPXSKNBN-VIFPVBQESA-N
PubChem ID :
519843
Rotatable bond count :
3
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.272569
Hydrogen bond donor count :
1
Electric dipole moment :
1.797
XLogP :
2.554
VDW volume :
185.033614
Molecular weight :
154.135765
HOMO-LUMO gap :
10.179000
Herb list :
Erio yarrow - Achillea eriophora - بومادران
St John's wort - Hypericum perforatum - گل راعی، هوفاریقون ، گل شهناز
Sweet wormwood - Artemisia annua - گندواش، درمنه خزری، درمنه یکساله
Wormwood - Artemisia sieberi - درمنه
Refrences & Litretures:
154. Journal:'Flavour Fragr. J' Year:'1997' Volume:'12' Page:'71' DOI:'' Title:'Constituents of the Essential Oil of Achillea eriophora DC'
327. Journal:'Journal of Essential Oil Research' Year:'2015' Volume:'27' Page:'140' DOI:'10.1080/10412905.2014.1001526' Title:'Chemical composition, antioxidant and antimicrobial activity of Artemisia sieberi oils from different parts of Iran and France'
525. Journal:'J. Chem. Pharm. Res' Year:'2010' Volume:'2' Page:'284' DOI:'' Title:'Essential oil composition of Hypericum perforatum L. and Hypericum scabrum L. growing wild in Tajikistan'
659. Journal:'Industrial Crops and Products' Year:'2012' Volume:'37' Page:'479' DOI:'10.1016/j.indcrop.2011.07.024' Title:'Chemical composition and antioxidant and antimicrobial activity of essential oil of Artemisia annua L. from Bosnia'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us