CHOLINE 5-OXOPROLINATE

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C5H14NO.C5H6NO3
Molecular Weight	232.2768
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of CHOLINE 5-OXOPROLINATE

Structure Search

SMILES

C[N+](C)(C)CCO.[O-]C(=O)[C@@H]1CCC(=O)N1

InChI

InChIKey=BYGUCEMASSQNBH-DFWYDOINSA-M

InChI=1S/C5H7NO3.C5H14NO/c7-4-2-1-3(6-4)5(8)9;1-6(2,3)4-5-7/h3H,1-2H2,(H,6,7)(H,8,9);7H,4-5H2,1-3H3/q;+1/p-1/t3-;/m0./s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

CHOLINE 5-OXOPROLINATE

Common Name

English

PROLINE, 5-OXO-, CHOLINE SALT

Systematic Name

English

2-HYDROXYETHYL)TRIMETHYLAMMONIUM 5-OXOPROLINATE

Systematic Name

English

ETHANAMINIUM, 2-HYDROXY-N,N,N-TRIMETHYL-, SALT WITH 5-OXOPROLINE (1:1)

Systematic Name

English

CHOLINE, SALT WITH 5-OXOPROLINE

Systematic Name

English

PROLINE, 5-OXO-, ION(1-), 2-HYDROXY-N,N,N-TRIMETHYLETHANAMINIUM

Systematic Name

English

Code System Code Type Description

FDA UNII

38BRN7U5AG

Created by admin on Fri Dec 15 19:51:52 UTC 2023 , Edited by admin on Fri Dec 15 19:51:52 UTC 2023

PRIMARY

CAS

5046-71-9

Created by admin on Fri Dec 15 19:51:52 UTC 2023 , Edited by admin on Fri Dec 15 19:51:52 UTC 2023

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PUBCHEM

6452214

Created by admin on Fri Dec 15 19:51:52 UTC 2023 , Edited by admin on Fri Dec 15 19:51:52 UTC 2023

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EPA CompTox

DTXSID30198489

Created by admin on Fri Dec 15 19:51:52 UTC 2023 , Edited by admin on Fri Dec 15 19:51:52 UTC 2023

PRIMARY

ECHA (EC/EINECS)

225-745-0

Created by admin on Fri Dec 15 19:51:52 UTC 2023 , Edited by admin on Fri Dec 15 19:51:52 UTC 2023

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SUBSTANCE RECORD


					38BRN7U5AG

CHOLINE 5-OXOPROLINATE