General Information of the Compound
| Compound ID |
CP0040448
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
CHEBI:17447
Show/Hide
|
||||||||||||||||||
| Synonyms |
(2E)-3,7-dimethylocta-2,6-dien-1-ol
(E)-3,7-Dimethyl-2,6-octadien-1-ol
(E)-3,7-Dimethylocta-2,6-dien-1-ol
(E)-Geraniol
(E)-Nerol
106-24-1
2,6-Octadien-1-ol, 3,7-dimethyl-
2,6-Octadien-1-ol, 3,7-dimethyl-, (2E)-
2-trans-3,7-Dimethyl-2,6-octadien-1-ol
2E-geraniol
3,7-Dimethyl-2,6-octadien-1-ol
3,7-Dimethyl-trans-2,6-octadien-1-ol
CHEBI:17447
GERANIOL
Geraniol (natural)
Geraniol Extra
Geraniol alcohol
Geranyl alcohol
Guaniol
Lemonol
beta-Geraniol
geraniol
t-geraniol
trans-3,7-Dimethyl-2,6-octadien-1-ol
trans-Geraniol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C10H18O
|
||||||||||||||||||
| Molecular Weight |
154.253
|
||||||||||||||||||
| Canonical SMILES |
CC(C)=CCC\C(C)=C\CO
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+
Show/Hide
|
||||||||||||||||||
| InChIKey |
GLZPCOQZEFWAFX-JXMROGBWSA-N
|
||||||||||||||||||
| CAS |
624-15-7
106-24-1
8007-13-4
68311-14-8
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
| DrugBank ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT02148, Transient receptor potential cation channel subfamily A member 1
Protein ID: PT05529, Transient receptor potential cation channel subfamily M member 8
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1
Clinical Information about the Compound