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Lenabasum

CAT: 0013-GTR19237291-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19237291-02Size:50 mg
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Description
A synthetic nonpsychoactive cannabinoid acid with potent analgesic and anti-inflammatory activity in vivo, binds directly and selectively to PPARγ; produces significant antitumor activity and effects its actions primarily via CB (2) receptors; inhibits interleukin-8 promoter activity in a PPARgamma-dependent manner; significantly suppresses CYP-induced urinary frequency in rats at 10 mg/kg.Fibrosis Phase 2 Clinical.
CAS Number
137945-48-3
Product Name Alternative
Ajulemic acid | IP-751 | Anabasum
Purity
>98% (HPLC)
Smiles
CCCCCCC (C) (C) C (C=C1OC (C) 2C) =CC (O) =C1[C@]3 (CC (C (O) =O) =CC[C@]23[H]) [H]
Molecular Formula
C25H36O4
Molecular Weight
400.559
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
(6aR,10aR) -1-hydroxy-6,6-dimethyl-3- (2-methyloctan-2-yl) -6a,7,10,10a-tetrahydro-6H-dibenzo[b, d]pyran-9-carboxylic acid

Chemical Information

Lenabasum

Ajulemic acid has been used in trials studying the treatment of Cystic Fibrosis, Dermatomyositis, and Diffuse Cutaneous Systemic Sclerosis.

CAS Number137945-48-3
PubChem CID3083542
IUPAC Name(6aR,10aR)-1-hydroxy-6,6-dimethyl-3-(2-methyloctan-2-yl)-6a,7,10,10a-tetrahydrobenzo[c]chromene-9-carboxylic acid
Molecular FormulaC25H36O4
Molecular Weight400.5
XLogP7
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count29
Formal Charge0
Complexity620
SMILES
CCCCCCC(C)(C)C1=CC(=C2[C@@H]3CC(=CC[C@H]3C(OC2=C1)(C)C)C(=O)O)O
InChI
InChI=1S/C25H36O4/c1-6-7-8-9-12-24(2,3)17-14-20(26)22-18-13-16(23(27)28)10-11-19(18)25(4,5)29-21(22)15-17/h10,14-15,18-19,26H,6-9,11-13H2,1-5H3,(H,27,28)/t18-,19-/m1/s1
InChIKey
YCHYFHOSGQABSW-RTBURBONSA-N
Chemical Structure
2D Structure
2D structure of Lenabasum
CAS: 137945-48-3
CID: 3083542
Formula: C25H36O4
MW: 400.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight400.5
XLogP37
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass400.26135963
Monoisotopic Mass400.26135963
Topological Polar Surface Area66.8 Ų
Heavy Atom Count29
Formal Charge0
Complexity620
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

Alternative Products

CatalogName
MBS3601565-01Lenabasum

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