D-617 HYDROCHLORIDE

Details

Stereochemistry	RACEMIC
Molecular Formula	C17H26N2O2.ClH
Molecular Weight	326.861
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CNCCCC(C#N)(C(C)C)C1=CC(OC)=C(OC)C=C1

InChI

InChIKey=ARLOHZJIIHSRFE-UHFFFAOYSA-N

InChI=1S/C17H26N2O2.ClH/c1-13(2)17(12-18,9-6-10-19-3)14-7-8-15(20-4)16(11-14)21-5;/h7-8,11,13,19H,6,9-10H2,1-5H3;1H

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

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

Molecular Formula	C17H26N2O2
Molecular Weight	290.4005
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
Verapamil: metabolism in cultures of primary human coronary arterial endothelial cells.	2003 Jul	12814965
Aerobic biodegradability of the calcium channel antagonist verapamil and identification of a microbial dead-end transformation product studied by LC-MS/MS.	2008 Jun	18400247
Synthesis and preclinical evaluation of [11C]D617, a metabolite of (R)-[11C]verapamil.	2012 May	22226023

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:09:56 GMT 2023` Edited by `admin` on `Sat Dec 16 11:09:56 GMT 2023`
Record UNII	J368YCA39W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

D-617 HYDROCHLORIDE

Common Name

English

VERAPAMIL RELATED COMPOUND A

Common Name

English

3,4-DIMETHOXY-ALPHA-(3-(METHYLAMINO)PROPYL)-.ALPHA.-(1-METHYLETHYL)-BENZENEACETONITRILE MONOHYDROCHLORIDE

Systematic Name

English

VERAPAMIL RELATED COMPOUND A [USP-RS]

Common Name

English

BENZENEACETONITRILE, 3,4-DIMETHOXY-.ALPHA.-(3-(METHYLAMINO)PROPYL)-.ALPHA.-(1-METHYLETHYL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

D-617 HYDROCHLORIDE, (RS)-

Code

English

Code System Code Type Description

PUBCHEM

19382807

Created by admin on Sat Dec 16 11:09:56 GMT 2023 , Edited by admin on Sat Dec 16 11:09:56 GMT 2023

PRIMARY

CAS

67775-97-7

Created by admin on Sat Dec 16 11:09:56 GMT 2023 , Edited by admin on Sat Dec 16 11:09:56 GMT 2023

PRIMARY

FDA UNII

J368YCA39W

Created by admin on Sat Dec 16 11:09:56 GMT 2023 , Edited by admin on Sat Dec 16 11:09:56 GMT 2023

PRIMARY

RS_ITEM_NUM

1711304

Created by admin on Sat Dec 16 11:09:56 GMT 2023 , Edited by admin on Sat Dec 16 11:09:56 GMT 2023

PRIMARY

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