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Chemical structure of JWH 081 4-hydroxynaphthyl metabolite

GC43966

JWH 081 4-hydroxynaphthyl metabolite

Also known as (4-hydroxynaphthalen-1-yl)-(1-pentylindol-3-yl)methanone

JWH 081 is a cannabimimetic indole related to JWH 015 and JWH 018 that shows preference for the central cannabinoid (CB1) receptor (Ki = 1·2 nM) over the peripheral cannabinoid (CB2) receptor (Ki = 12·4 nM)

ChemicalCAS1393345-76-0MW357.4FormulaC24H23NO2
CAS number
1393345-76-0
Molecular weight
357.4
Formula
C24H23NO2
Solubility
DMF： 10 mg/ml,DMSO： 10 mg/ml,Ethanol： 10 mg/ml,Methanol： 30 mg/ml
InChIKey
SVZBBFXTYNKESE-UHFFFAOYSA-N
Catalogue number
GC43966
Brand
GLPBIO
Computed properties PubChem CID 68186987 · XLogP 6 · TPSA 42.2 Ų · H-bond donors 1
XLogP
6
TPSA
42.2 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
27

SMILES CCCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=C(C4=CC=CC=C43)O

Computed descriptors from PubChem (CID 68186987), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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