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O-1602

CAT: 0607-B7191-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-B7191-10Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
GPR55 cannabinoid receptor agonist
CAS Number
317321-41-8
Product Name Alternative
(1'R,2'R)-5',6-dimethyl-2'-(prop-1-en-2-yl)-1',2',3',4'-tetrahydro-[1,1'-biphenyl]-2,4-diol
Field of Research
GPCR G protein GPR55
Purity
0.98
Form
A solution in methyl acetate
Solubility
Soluble in methyl acetate
Smiles
OC1=C(C(C)=CC(O)=C1)[C@H]2[C@H](C(C)=C)CCC(C)=C2
Molecular Formula
C17H22O2
Molecular Weight
258.36
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

5-Methyl-4-((1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl)-1,3-benzenediol
CAS Number317321-41-8
PubChem CID45073499
IUPAC Name5-methyl-4-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]benzene-1,3-diol
Molecular FormulaC17H22O2
Molecular Weight258.35
XLogP4.5
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity371
SMILES
CC1=C[C@H]([C@@H](CC1)C(=C)C)C2=C(C=C(C=C2C)O)O
InChI
InChI=1S/C17H22O2/c1-10(2)14-6-5-11(3)7-15(14)17-12(4)8-13(18)9-16(17)19/h7-9,14-15,18-19H,1,5-6H2,2-4H3/t14-,15+/m0/s1
InChIKey
KDZOUSULXZNDJH-LSDHHAIUSA-N
Chemical Structure
2D Structure
2D structure of 5-Methyl-4-((1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl)-1,3-benzenediol
CAS: 317321-41-8
CID: 45073499
Formula: C17H22O2
MW: 258.35
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight258.35
XLogP34.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass258.161979940
Monoisotopic Mass258.161979940
Topological Polar Surface Area40.5 Ų
Heavy Atom Count19
Formal Charge0
Complexity371
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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