BETAINE CITRATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H7O7.C5H12NO2
Molecular Weight	309.2699
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BETAINE CITRATE

Structure Search

SMILES

C[N+](C)(C)CC(O)=O.OC(=O)CC(O)(CC(O)=O)C([O-])=O

InChI

InChIKey=YKXUOESQDCXGIW-UHFFFAOYSA-N

InChI=1S/C6H8O7.C5H11NO2/c7-3(8)1-6(13,5(11)12)2-4(9)10;1-6(2,3)4-5(7)8/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C5H11NO2
Molecular Weight	117.1463
Charge	0
Count

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

Molecular Formula	C6H8O7
Molecular Weight	192.1235
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 14:59:54 UTC 2023` Edited by `admin` on `Fri Dec 15 14:59:54 UTC 2023`
Record UNII	19JX795NXV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BETAINE CITRATE

Common Name

English

(CARBOXYMETHYL)TRIMETHYLAMMONIUM DIHYDROGEN CITRATE

Systematic Name

English

METHANAMINIUM, 1-CARBOXY-N,N,N-TRIMETHYL-, 2-HYDROXY-1,2,3-PROPANETRICARBOXYLATE (1:1)

Systematic Name

English

BETAINE CHOLINE CITRATE

Common Name

English

1,2,3-PROPANETRICARBOXYLIC ACID, 2-HYDROXY-, ION(1-), 1-CARBOXY-N,N,N-TRIMETHYLMETHANAMINIUM

Common Name

English

Betaine citrate [WHO-DD]

Common Name

English

METHANAMINIUM, 1-CARBOXY-N,N,N-TRIMETHYL-, SALT WITH 2-HYDROXY-1,2,3-PROPANETRICARBOXYLIC ACID (1:1)

Systematic Name

English

Code System Code Type Description

PUBCHEM

83838

Created by admin on Fri Dec 15 14:59:54 UTC 2023 , Edited by admin on Fri Dec 15 14:59:54 UTC 2023

PRIMARY

SMS_ID

100000089318

Created by admin on Fri Dec 15 14:59:54 UTC 2023 , Edited by admin on Fri Dec 15 14:59:54 UTC 2023

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FDA UNII

19JX795NXV

Created by admin on Fri Dec 15 14:59:54 UTC 2023 , Edited by admin on Fri Dec 15 14:59:54 UTC 2023

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ECHA (EC/EINECS)

241-648-6

Created by admin on Fri Dec 15 14:59:54 UTC 2023 , Edited by admin on Fri Dec 15 14:59:54 UTC 2023

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DRUG BANK

DBSALT002227

Created by admin on Fri Dec 15 14:59:54 UTC 2023 , Edited by admin on Fri Dec 15 14:59:54 UTC 2023

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CAS

17671-50-0

Created by admin on Fri Dec 15 14:59:54 UTC 2023 , Edited by admin on Fri Dec 15 14:59:54 UTC 2023

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EVMPD

SUB13057MIG

Created by admin on Fri Dec 15 14:59:54 UTC 2023 , Edited by admin on Fri Dec 15 14:59:54 UTC 2023

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MESH

C018229

Created by admin on Fri Dec 15 14:59:54 UTC 2023 , Edited by admin on Fri Dec 15 14:59:54 UTC 2023

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RXCUI

160460

Created by admin on Fri Dec 15 14:59:54 UTC 2023 , Edited by admin on Fri Dec 15 14:59:54 UTC 2023

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RxNorm

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Amount: