7-HYDROXY-PIPAT MALEATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H22INO.C4H4O4
Molecular Weight	487.3286
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.CCCN(C\C=C\I)C1CCC2=CC=C(O)C=C2C1

InChI

InChIKey=IQRDHLSQXOATHD-HBRCEPSSSA-N

InChI=1S/C16H22INO.C4H4O4/c1-2-9-18(10-3-8-17)15-6-4-13-5-7-16(19)12-14(13)11-15;5-3(6)1-2-4(7)8/h3,5,7-8,12,15,19H,2,4,6,9-11H2,1H3;1-2H,(H,5,6)(H,7,8)/b8-3+;2-1-

HIDE SMILES / InChI

Molecular Formula	C4H4O4
Molecular Weight	116.0722
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Molecular Formula	C16H22INO
Molecular Weight	371.2564
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	1
Optical Activity	( + / - )

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
D(3) dopamine receptor 16 Target ID: P35462 Gene ID: 1814.0 Gene Symbol: DRD3 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/8519278	Agonist 2678		0.48 nM [Kd]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:33:10 GMT 2023` Edited by `admin` on `Sat Dec 16 08:33:10 GMT 2023`
Record UNII	977JC7EV31
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

7-HYDROXY-PIPAT MALEATE

Common Name

English

2-NAPHTHALENOL, 5,6,7,8-TETRAHYDRO-7-(((2E)-3-IODO-2-PROPENYL)PROPYLAMINO)-, (2Z)-2-BUTENEDIOATE (1:1) (SALT)

Systematic Name

English

7-HYDROXY-PIPAT MALEATE, (±)-

Common Name

English

7-HYDROXY-2-(N-N-PROPYL-N-(3'-IODO-2'-PROPENYL)AMINO)TETRALIN MALEATE

Systematic Name

English

Code System Code Type Description

CHEBI

64134

Created by admin on Sat Dec 16 08:33:10 GMT 2023 , Edited by admin on Sat Dec 16 08:33:10 GMT 2023

PRIMARY

FDA UNII

977JC7EV31

Created by admin on Sat Dec 16 08:33:10 GMT 2023 , Edited by admin on Sat Dec 16 08:33:10 GMT 2023

PRIMARY

PUBCHEM

24978534

Created by admin on Sat Dec 16 08:33:10 GMT 2023 , Edited by admin on Sat Dec 16 08:33:10 GMT 2023

PRIMARY

CAS

200722-46-9

Created by admin on Sat Dec 16 08:33:10 GMT 2023 , Edited by admin on Sat Dec 16 08:33:10 GMT 2023

PRIMARY

Related Record Type Details


					N7GRI8K5R7

7-HYDROXY-PIPAT

PARENT -> SALT/SOLVATE