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Chemical structure of (±)-JWH 018 N-(3-hydroxypentyl) metabolite

GC41674

(±)-JWH 018 N-(3-hydroxypentyl) metabolite

Also known as [1-(3-hydroxypentyl)indol-3-yl]-naphthalen-1-ylmethanone

(±)-JWH 018 N-(3-hydroxypentyl) metabolite is a potential metabolite of JWH 018

ChemicalCAS1936529-85-9MW357.5FormulaC24H23NO2
CAS number
1936529-85-9
Molecular weight
357.5
Formula
C24H23NO2
Solubility
DMF： 20 mg/ml,DMSO： 20 mg/ml,Ethanol： 30 mg/ml,Ethanol：PBS (pH 7·2) (1：3)： 0·25 mg/ml,Methanol：PBS (pH 7·2) (1：3)： 0·25 mg/ml
InChIKey
VSFMJFFDYLVSBU-UHFFFAOYSA-N
Catalogue number
GC41674
Brand
GLPBIO
Computed properties PubChem CID 91713063 · XLogP 5.2 · TPSA 42.2 Ų · H-bond donors 1
XLogP
5.2
TPSA
42.2 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
27

SMILES CCC(CCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=CC4=CC=CC=C43)O

Computed descriptors from PubChem (CID 91713063), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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