Basic information
- CAS
432047-72-8- Standard SMILES
CCCCCOc1ccc(C(=O)c2cccc3ccccc23)c2ccccc12- InChIKey
RSUMDJRTAFBISX-UHFFFAOYSA-N- Molecular formula
- C26H24O2
- Average molar mass
- 368.5 g/mol
- Monoisotopic mass
- 368.17763
Overview
CB-13 is a member of benzophenones.
Names & identifiers
- Preferred name
- Cra 13
- IUPAC
- naphthalen-1-yl-(4-pentoxynaphthalen-1-yl)methanone
- English name
- CB 13
- Molecular formula
- C26H24O2
- Molecular weight
- 368.47
Names & synonyms
432047-72-8CB 13CB-13CRA-131-Naphthalenyl[4-(pentyloxy)-1-naphthalenyl]methanone9XRJ6055XT1-Naphthalenyl(4-(pentyloxy)-1-naphthalenyl)methanoneMethanone, 1-naphthalenyl(4-(pentyloxy)-1-naphthalenyl)-RefChem:919148Cra 13CB13 compoundCB13
Show more names
SAB 378Naphthalen-1-yl[4-(pentyloxy)-naphthalen-1-yl]MethanoneMethanone, 1-naphthalenyl[4-(pentyloxy)-1-naphthalenyl]-
naphthalen-1-yl-(4-pentyloxynaphthalen-1-yl)methanoneCRA13NVP-SAB378UNII-9XRJ6055XTNaphthalen-1-yl-(4-pentoxynaphthalen-1-yl)methanoneCHEMBL244403MFCD11519954C26H24O2
Database identifiers
- CAS
432047-72-8- PubChem CID
- 9799417
- DTXSID
DTXSID60430920- ChEMBL
CHEMBL244403- ChEBI
CHEBI:185985- UNII
- 9XRJ6055XT
- Nikkaji
- J3.065.111A
Properties
Computed structural properties
- XLogP
- 7.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 501
Experimental & physicochemical properties
Drugs
DEA NFLIS-Drug Category -> Synthetic Cannabinoids
Synthetic Cannabinoids
Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds
Collision Cross Section200.92 Ų [M+H]+
Physicochemical properties
- Melting point
- 63 · 63-66°C
- Boiling point
- 559.8 · 559.8±33.0 °C(Predicted)
- Density
- 1.13 · 1.130±0.06 g/cm3(Predicted)
- storage temp.
- Store at RT
- solubility
- DMSO (Slightly)
- form
- Solid
- color
- White
- FDA UNII
- 9 XRJ6055XT · 9XRJ6055XT
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Compounds capable of relieving pain without the loss of CONSCIOUSNESS.
Compounds that interact with and stimulate the activity of CANNABINOID RECEPTORS.
Applications
UsesCB 13 is a potent CB1/CB2receptor agonist with limited brain penetration. Also, it is a cannabinoid derivative which has an important potential as analgesic in chronic pain.Synthetic Cannabinoids
Additional notes
DefinitionChEBI: CB-13 is a member of benzophenones.
Related reactions
2 records
Compound notes
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