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Details

Stereochemistry RACEMIC
Molecular Formula 2C9H16NO5.Ca
Molecular Weight 476.532
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CALCIUM PANTOTHENATE, (±)-

SMILES

[Ca++].CC(C)(CO)C(O)C(=O)NCCC([O-])=O.CC(C)(CO)C(O)C(=O)NCCC([O-])=O

InChI

InChIKey=FAPWYRCQGJNNSJ-UHFFFAOYSA-L
InChI=1S/2C9H17NO5.Ca/c2*1-9(2,5-11)7(14)8(15)10-4-3-6(12)13;/h2*7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);/q;;+2/p-2

HIDE SMILES / InChI

Approval Year

Name Type Language
CALCIUM PANTOTHENATE, RACEMIC
FCC   USP  
Preferred Name English
CALCIUM PANTOTHENATE, (±)-
Systematic Name English
CALCIUM PANTOTHENATE, RACEMIC [USP IMPURITY]
Common Name English
.BETA.-ALANINE, N-(2,4-DIHYDROXY-3,3-DIMETHYL-1-OXOBUTYL)-, CALCIUM SALT (2:1), (±)-
Common Name English
CALCIUM DL-PANTOTHENATE (1:2)
Systematic Name English
CALCIUM PANTOTHENATE,RACEMIC
VANDF  
Common Name English
CALCIUM PANTOTHENATE,RACEMIC [VANDF]
Common Name English
CALCIUM DL-PANTOTHENATE
Systematic Name English
CALCIUM (1)-N-(2,4-DIHYDROXY-3,3-DIMETHYL-1-OXOBUTYL)-BETA-ALANINATE
Common Name English
.BETA.-ALANINE, N-(2,4-DIHYDROXY-3,3-DIMETHYL-1-OXOBUTYL)-, CALCIUM SALT (2:1)
Common Name English
CALCIUM PANTOTHENATE, RACEMIC [FCC]
Common Name English
Code System Code Type Description
PUBCHEM
2529
Created by admin on Mon Mar 31 18:40:03 GMT 2025 , Edited by admin on Mon Mar 31 18:40:03 GMT 2025
PRIMARY
FDA UNII
2KC899R47Q
Created by admin on Mon Mar 31 18:40:03 GMT 2025 , Edited by admin on Mon Mar 31 18:40:03 GMT 2025
PRIMARY
EPA CompTox
DTXSID40890624
Created by admin on Mon Mar 31 18:40:03 GMT 2025 , Edited by admin on Mon Mar 31 18:40:03 GMT 2025
PRIMARY
CAS
6381-63-1
Created by admin on Mon Mar 31 18:40:03 GMT 2025 , Edited by admin on Mon Mar 31 18:40:03 GMT 2025
PRIMARY
ECHA (EC/EINECS)
228-972-3
Created by admin on Mon Mar 31 18:40:03 GMT 2025 , Edited by admin on Mon Mar 31 18:40:03 GMT 2025
PRIMARY
ChEMBL
CHEMBL2110806
Created by admin on Mon Mar 31 18:40:03 GMT 2025 , Edited by admin on Mon Mar 31 18:40:03 GMT 2025
PRIMARY