3,6-DIOXO-5-(PHENYLMETHYL)-2-PIPERAZINEACETIC ACID, (2S,5S)-

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Details

Stereochemistry	ABSOLUTE
Molecular Formula	C13H14N2O4
Molecular Weight	262.2613
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,6-DIOXO-5-(PHENYLMETHYL)-2-PIPERAZINEACETIC ACID, (2S,5S)-

Structure Search

SMILES

OC(=O)C[C@@H]1NC(=O)[C@H](CC2=CC=CC=C2)NC1=O

InChI

InChIKey=VNHJXYUDIBQDDX-UWVGGRQHSA-N

InChI=1S/C13H14N2O4/c16-11(17)7-10-13(19)14-9(12(18)15-10)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,14,19)(H,15,18)(H,16,17)/t9-,10-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C13H14N2O4
Molecular Weight	262.2613
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:12:31 UTC 2023` Edited by `admin` on `Sat Dec 16 09:12:31 UTC 2023`
Record UNII	ZM82VP15YJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,6-DIOXO-5-(PHENYLMETHYL)-2-PIPERAZINEACETIC ACID, (2S,5S)-

Common Name

English

ASPARTAME RELATED COMPOUND A

Common Name

English

2-PIPERAZINEACETIC ACID, 3,6-DIOXO-5-(PHENYLMETHYL)-, (2S-CIS)-

Systematic Name

English

ASPARTAME DIKETOPIPERAZINE

Common Name

English

2-PIPERAZINEACETIC ACID, 3,6-DIOXO-5-(PHENYLMETHYL)-, (2S,5S)-

Common Name

English

ASPARTAME RELATED COMPOUND A [USP-RS]

Common Name

English

Code System Code Type Description

FDA UNII

ZM82VP15YJ

Created by admin on Sat Dec 16 09:12:31 UTC 2023 , Edited by admin on Sat Dec 16 09:12:31 UTC 2023

PRIMARY

PUBCHEM

111054

Created by admin on Sat Dec 16 09:12:31 UTC 2023 , Edited by admin on Sat Dec 16 09:12:31 UTC 2023

PRIMARY

RS_ITEM_NUM

1043728

Created by admin on Sat Dec 16 09:12:31 UTC 2023 , Edited by admin on Sat Dec 16 09:12:31 UTC 2023

PRIMARY

EPA CompTox

DTXSID60200600

Created by admin on Sat Dec 16 09:12:31 UTC 2023 , Edited by admin on Sat Dec 16 09:12:31 UTC 2023

PRIMARY

ECHA (EC/EINECS)

226-075-1

Created by admin on Sat Dec 16 09:12:31 UTC 2023 , Edited by admin on Sat Dec 16 09:12:31 UTC 2023

PRIMARY

CAS

5262-10-2

Created by admin on Sat Dec 16 09:12:31 UTC 2023 , Edited by admin on Sat Dec 16 09:12:31 UTC 2023

PRIMARY

Related Record Type Details


					Z0H242BBR1

ASPARTAME

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (GC)

Amount: