U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C6H7O6.C5H12NO2
Molecular Weight 293.2705
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BETAINE L-ASCORBATE

SMILES

C[N+](C)(C)CC(O)=O.[H][C@@]1(OC(=O)C([O-])=C1O)[C@@H](O)CO

InChI

InChIKey=GFEOHZQDQDLTSZ-RXSVEWSESA-N
InChI=1S/C6H8O6.C5H11NO2/c7-1-2(8)5-3(9)4(10)6(11)12-5;1-6(2,3)4-5(7)8/h2,5,7-10H,1H2;4H2,1-3H3/t2-,5+;/m0./s1

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 C6H8O6
Molecular Weight 176.1241
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 04:18:56 GMT 2023
Edited
by admin
on Sat Dec 16 04:18:56 GMT 2023
Record UNII
N7DLK74S5K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BETAINE L-ASCORBATE
Common Name English
Betaine ascorbate [WHO-DD]
Common Name English
L-ASCORBIC ACID, COMPD. WITH BETAINE
Common Name English
(CARBOXYMETHYL)TRIMETHYLAMMONIUM ASCORBATE
Common Name English
L-ASCORBIC ACID, ION(1-), 1-CARBOXY-N,N,N-TRIMETHYLMETHANAMINIUM
Common Name English
BETAINE, ASCORBATE
Common Name English
BETAINE ASCORBATE
WHO-DD  
Common Name English
AMINOX
Brand Name English
METHANAMINIUM, 1-CARBOXY-N,N,N-TRIMETHYL-, SALT WITH L-ASCORBIC ACID (1:1)
Common Name English
Code System Code Type Description
PUBCHEM
54693466
Created by admin on Sat Dec 16 04:18:56 GMT 2023 , Edited by admin on Sat Dec 16 04:18:56 GMT 2023
PRIMARY
EVMPD
SUB13056MIG
Created by admin on Sat Dec 16 04:18:56 GMT 2023 , Edited by admin on Sat Dec 16 04:18:56 GMT 2023
PRIMARY
ECHA (EC/EINECS)
242-202-3
Created by admin on Sat Dec 16 04:18:56 GMT 2023 , Edited by admin on Sat Dec 16 04:18:56 GMT 2023
PRIMARY
FDA UNII
N7DLK74S5K
Created by admin on Sat Dec 16 04:18:56 GMT 2023 , Edited by admin on Sat Dec 16 04:18:56 GMT 2023
PRIMARY
EPA CompTox
DTXSID60939680
Created by admin on Sat Dec 16 04:18:56 GMT 2023 , Edited by admin on Sat Dec 16 04:18:56 GMT 2023
PRIMARY
SMS_ID
100000092031
Created by admin on Sat Dec 16 04:18:56 GMT 2023 , Edited by admin on Sat Dec 16 04:18:56 GMT 2023
PRIMARY
EVMPD
SUB130129
Created by admin on Sat Dec 16 04:18:56 GMT 2023 , Edited by admin on Sat Dec 16 04:18:56 GMT 2023
PRIMARY
CAS
18312-58-8
Created by admin on Sat Dec 16 04:18:56 GMT 2023 , Edited by admin on Sat Dec 16 04:18:56 GMT 2023
PRIMARY