FUB-PB-22

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H17FN2O2
Molecular Weight	396.4131
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

FC1=CC=C(CN2C=C(C(=O)OC3=C4N=CC=CC4=CC=C3)C5=CC=CC=C25)C=C1

InChI

InChIKey=ROHVURVXAOMRJY-UHFFFAOYSA-N

InChI=1S/C25H17FN2O2/c26-19-12-10-17(11-13-19)15-28-16-21(20-7-1-2-8-22(20)28)25(29)30-23-9-3-5-18-6-4-14-27-24(18)23/h1-14,16H,15H2

HIDE SMILES / InChI

Molecular Formula	C25H17FN2O2
Molecular Weight	396.4131
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/26810398 | https://www.ncbi.nlm.nih.gov/pubmed/27429655

FDU-PB-22 (naphthalen-1-yl 1-[(4-fluorophenyl)methyl]-1H-indole-3-carboxylate) is a synthetic cannabinoid. It is considered to be a constituent of illicit smoking mixtures "spice".

CNS Activity

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Cannabinoid CB1 receptor 85 Target ID: CHEMBL218 Sources: https://www.ncbi.nlm.nih.gov/pubmed/27429655	Agonist 2678		0.386 nM [Ki]
Cannabinoid CB2 receptor 71 Target ID: CHEMBL253 Sources: https://www.ncbi.nlm.nih.gov/pubmed/27429655	Agonist 2678		0.478 nM [Ki]

Conditions

Condition	Modality	Targets	Highest Phase	Product
Unknown 2578

PubMed

Title	Date	PubMed
Pharmacological evaluation of synthetic cannabinoids identified as constituents of spice.	2016	27429655
In Vitro and In Vivo Human Metabolism of Synthetic Cannabinoids FDU-PB-22 and FUB-PB-22.	2016 Mar	26810398
New psychoactive substances: Studies on the metabolism of XLR-11, AB-PINACA, FUB-PB-22, 4-methoxy-α-PVP, 25-I-NBOMe, and meclonazepam using human liver preparations in comparison to primary human hepatocytes, and human urine.	2017 Oct 5	28782580
AB-CHMINACA-induced sudden death from non-cardiogenic pulmonary edema.	2018 Feb	28707493
Discrimination between closely related synthetic cannabinoids by GC-Cold-EI-MS.	2018 Mar	28688175

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Unknown

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:16:43 UTC 2023` Edited by `admin` on `Sat Dec 16 10:16:43 UTC 2023`
Record UNII	DS46154N3F
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

FUB-PB-22

Common Name

English

1-(4-FLUOROBENZYL)-1H-INDOLE-3-CARBOXYLIC ACID 8-QUINOLYL ESTER

Systematic Name

English

J3.314.547K

Code

English

1H-INDOLE-3-CARBOXYLIC ACID, 1-((4-FLUOROPHENYL)METHYL)-, 8-QUINOLINYL ESTER

Systematic Name

English

Classification Tree Code System Code

WIKIPEDIA

Designer-drugs-FUB-PB-22