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Details

Stereochemistry ABSOLUTE
Molecular Formula C8H17NO6S
Molecular Weight 255.289
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PANTOYLTAURINE

SMILES

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

InChI

InChIKey=IZRUXXTXKZAGQQ-LURJTMIESA-N
InChI=1S/C8H17NO6S/c1-8(2,5-10)6(11)7(12)9-3-4-16(13,14)15/h6,10-11H,3-5H2,1-2H3,(H,9,12)(H,13,14,15)/t6-/m0/s1

HIDE SMILES / InChI

Molecular Formula C8H17NO6S
Molecular Weight 255.289
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 Mon Mar 31 21:00:59 GMT 2025
Edited
by admin
on Mon Mar 31 21:00:59 GMT 2025
Record UNII
O0WNV00608
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-122022
Preferred Name English
PANTOYLTAURINE
Systematic Name English
TAURINE, N-(2,4-DIHYDROXY-3,3-DIMETHYLBUTYRYL)-
Systematic Name English
ETHANESULFONIC ACID, 2-(((2R)-2,4-DIHYDROXY-3,3-DIMETHYL-1-OXOBUTYL)AMINO)-
Systematic Name English
2-(((2R)-2,4-DIHYDROXY-3,3-DIMETHYL-1-OXOBUTYL)AMINO)ETHANESULFONIC ACID
Systematic Name English
THIOPANIC ACID
Common Name English
SULFOPANTOTHENIC ACID
Systematic Name English
NSC-3086
Code English
Code System Code Type Description
PUBCHEM
21118785
Created by admin on Mon Mar 31 21:00:59 GMT 2025 , Edited by admin on Mon Mar 31 21:00:59 GMT 2025
PRIMARY
NSC
122022
Created by admin on Mon Mar 31 21:00:59 GMT 2025 , Edited by admin on Mon Mar 31 21:00:59 GMT 2025
PRIMARY
FDA UNII
O0WNV00608
Created by admin on Mon Mar 31 21:00:59 GMT 2025 , Edited by admin on Mon Mar 31 21:00:59 GMT 2025
PRIMARY
CAS
2545-84-8
Created by admin on Mon Mar 31 21:00:59 GMT 2025 , Edited by admin on Mon Mar 31 21:00:59 GMT 2025
PRIMARY
NSC
3086
Created by admin on Mon Mar 31 21:00:59 GMT 2025 , Edited by admin on Mon Mar 31 21:00:59 GMT 2025
PRIMARY