DIKETOPIPERAZINE MOEXIPRILAT

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H28N2O6
Molecular Weight	452.4996
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DIKETOPIPERAZINE MOEXIPRILAT

Structure Search

SMILES

[H][C@@]12CC3=C(CN1C(=O)[C@H](C)N([C@@H](CCC4=CC=CC=C4)C(O)=O)C2=O)C=C(OC)C(OC)=C3

InChI

InChIKey=IIPIDAGAGXRRKJ-YSSFQJQWSA-N

InChI=1S/C25H28N2O6/c1-15-23(28)26-14-18-13-22(33-3)21(32-2)12-17(18)11-20(26)24(29)27(15)19(25(30)31)10-9-16-7-5-4-6-8-16/h4-8,12-13,15,19-20H,9-11,14H2,1-3H3,(H,30,31)/t15-,19-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H28N2O6
Molecular Weight	452.4996
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:45:04 UTC 2023` Edited by `admin` on `Sat Dec 16 08:45:04 UTC 2023`
Record UNII	J90D0W173C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DIKETOPIPERAZINE MOEXIPRILAT

Common Name

English

2H-PYRAZINO(1,2-B)ISOQUINOLINE-2-ACETIC ACID, 1,3,4,6,11,11A-HEXAHYDRO-8,9-DIMETHOXY-3-METHYL-1,4-DIOXO-.ALPHA.-(2-PHENYLETHYL)-, (.ALPHA.S,3S,11AS)-

Systematic Name

English

Code System Code Type Description

FDA UNII

J90D0W173C

Created by admin on Sat Dec 16 08:45:04 UTC 2023 , Edited by admin on Sat Dec 16 08:45:04 UTC 2023

PRIMARY

PUBCHEM

91810603

Created by admin on Sat Dec 16 08:45:04 UTC 2023 , Edited by admin on Sat Dec 16 08:45:04 UTC 2023

PRIMARY

CAS

112468-23-2

Created by admin on Sat Dec 16 08:45:04 UTC 2023 , Edited by admin on Sat Dec 16 08:45:04 UTC 2023

PRIMARY

Related Record Type Details


					H3753190JS

MOEXIPRILAT

PARENT -> METABOLITE

Interaction Type:

MINOR

Qualification:

FECAL; PLASMA; URINE