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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H22N2O6
Molecular Weight 290.3129
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of β-alanyl pantothenamide

SMILES

CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)NCCC(O)=O

InChI

InChIKey=ZEFQNPXWTQSVAH-JTQLQIEISA-N
InChI=1S/C12H22N2O6/c1-12(2,7-15)10(19)11(20)14-5-3-8(16)13-6-4-9(17)18/h10,15,19H,3-7H2,1-2H3,(H,13,16)(H,14,20)(H,17,18)/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H22N2O6
Molecular Weight 290.3129
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:19:11 GMT 2023
Edited
by admin
on Sat Dec 16 19:19:11 GMT 2023
Record UNII
Y8JBU55TWT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
β-alanyl pantothenamide
Common Name English
β-Alanine, N-D-pantothenoyl-
Systematic Name English
β-Alanine, N-[(2R)-2,4-dihydroxy-3,3-dimethyl-1-oxobutyl]-β-alanyl-
Common Name English
N-[(2R)-2,4-Dihydroxy-3,3-dimethyl-1-oxobutyl]-β-alanyl-β-alanine
Systematic Name English
Code System Code Type Description
PUBCHEM
141121107
Created by admin on Sat Dec 16 19:19:11 GMT 2023 , Edited by admin on Sat Dec 16 19:19:11 GMT 2023
PRIMARY
FDA UNII
Y8JBU55TWT
Created by admin on Sat Dec 16 19:19:11 GMT 2023 , Edited by admin on Sat Dec 16 19:19:11 GMT 2023
PRIMARY
CAS
897045-90-8
Created by admin on Sat Dec 16 19:19:11 GMT 2023 , Edited by admin on Sat Dec 16 19:19:11 GMT 2023
PRIMARY
Related Record Type Details
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