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: 30
About
About PHCD
The Team
Sponsors
Publications
Citing
Contact Us
Sign in >
cis-Pinocarveol
ScientificNameLabel
cis-Pinocarveol
PHCD compound ID :
286
Chemical Names :
cis-Pinocarveol , cis-Pinocarveole
Molecular Formula :
C10H16O1
Molecular Weight :
152.120115
More Details :
Names & Synonyms:
(1S,3S,5S)-6,6-dimethyl-2-methylene-norpinan-3-ol , (1S,3S,5S)-6,6-dimethyl-4-methylene-3-bicyclo[3.1.1]heptanol , (1S,3S,5S)-6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-ol , (1S,3S,5S)-6,6-dimethyl-4-methylidene-bicyclo[3.1.1]heptan-3-ol
Smiles:
C=C1[C@@H](O)C[C@@H]2C[C@H]1C2(C)C
InChi :
InChI=1S/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h7-9,11H,1,4-5H2,2-3H3/t7-,8+,9-/m0/s1
InChi Key :
InChIKey=LCYXQUJDODZYIJ-YIZRAAEISA-N
PubChem ID :
88297
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.787567
Hydrogen bond donor count :
1
Electric dipole moment :
2.232
XLogP :
2.192
VDW volume :
162.957156
Molecular weight :
152.120115
HOMO-LUMO gap :
10.695000
Herb list :
Absinthium, Wormwood - Artemisia absinthium - افسنطین
Black cumin, Nutmeg flower, Fennel-flower, Roman coriander - Nigella sativa - سیاه دانه، شونیز
Camphre - Cinnamomum camphora - کافور
Erio yarrow - Achillea eriophora - بومادران
Refrences & Litretures:
17. Journal:'Pharm Biol' Year:'2013' Volume:'51' Page:'888' DOI:'10.3109/13880209.2013.768676' Title:'Volatile composition and antimicrobial activity of the essential oil of Artemisia absinthium growing in Western Ghats region of North West Karnataka, India'
151. Journal:'Journal of Essential Oil Bearing Plants' Year:'2011' Volume:'14' Page:'617' DOI:'10.1080/0972060X.2011.10643980' Title:'Comparison of Chemical Composition of Achillea eriophora and A. wilhelmsii Grown in Wild and Cultivated Conditions in Iran'
459. Journal:'Flavour Fragr. J' Year:'2007' Volume:'22' Page:'148' DOI:'10.1002/ffj.1773' Title:'Chemical composition of seed essential oils from Algerian Nigella sativa extracted by microwave and hydrodistillation'
563. Journal:'??????' Year:'2009' Volume:'31' Page:'77' DOI:'' Title:'Essential Oil Compositions and Bioactivities of the Various Pa r t s of Cinnamomum camphora Sieb. var. linaloolifera Fujuta'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us