2-DESPIPERIDYL-2-AMINO REPAGLINIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H28N2O4
Molecular Weight	384.4687
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-DESPIPERIDYL-2-AMINO REPAGLINIDE

Structure Search

SMILES

CCOC1=C(C=CC(CC(=O)N[C@@H](CC(C)C)C2=C(N)C=CC=C2)=C1)C(O)=O

InChI

InChIKey=OSCVKZCOJUTUFD-IBGZPJMESA-N

InChI=1S/C22H28N2O4/c1-4-28-20-12-15(9-10-17(20)22(26)27)13-21(25)24-19(11-14(2)3)16-7-5-6-8-18(16)23/h5-10,12,14,19H,4,11,13,23H2,1-3H3,(H,24,25)(H,26,27)/t19-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H28N2O4
Molecular Weight	384.4687
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:59:53 UTC 2023` Edited by `admin` on `Sat Dec 16 08:59:53 UTC 2023`
Record UNII	Z5LJV2074G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-DESPIPERIDYL-2-AMINO REPAGLINIDE

Common Name

English

REPAGLINIDE (M1)

Common Name

English

BENZOIC ACID, 4-(2-(((1S)-1-(2-AMINOPHENYL)-3-METHYLBUTYL)AMINO)-2-OXOETHYL)-2-ETHOXY-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID20652540

Created by admin on Sat Dec 16 08:59:53 UTC 2023 , Edited by admin on Sat Dec 16 08:59:53 UTC 2023

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CAS

637301-29-2

Created by admin on Sat Dec 16 08:59:53 UTC 2023 , Edited by admin on Sat Dec 16 08:59:53 UTC 2023

PRIMARY

PUBCHEM

29977666

Created by admin on Sat Dec 16 08:59:53 UTC 2023 , Edited by admin on Sat Dec 16 08:59:53 UTC 2023

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FDA UNII

Z5LJV2074G

Created by admin on Sat Dec 16 08:59:53 UTC 2023 , Edited by admin on Sat Dec 16 08:59:53 UTC 2023

PRIMARY

Related Record Type Details


					668Z8C33LU

REPAGLINIDE

PARENT -> METABOLITE

Comments:

CYP2C8 and 3A4 in vitro

Qualification:

FECAL; PLASMA; URINE