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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H18N6O6S
Molecular Weight 458.448
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 10-THIOFOLIC ACID

SMILES

NC1=NC(=O)C2=NC(CSC3=CC=C(C=C3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=CNC2=N1

InChI

InChIKey=VUCAAEQMBTVEOL-LBPRGKRZSA-N
InChI=1S/C19H18N6O6S/c20-19-24-15-14(17(29)25-19)22-10(7-21-15)8-32-11-3-1-9(2-4-11)16(28)23-12(18(30)31)5-6-13(26)27/h1-4,7,12H,5-6,8H2,(H,23,28)(H,26,27)(H,30,31)(H3,20,21,24,25,29)/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H18N6O6S
Molecular Weight 458.448
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 Tue Apr 01 19:49:50 GMT 2025
Edited
by admin
on Tue Apr 01 19:49:50 GMT 2025
Record UNII
8NRE29SB6K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
10-THIOFOLIC ACID
Common Name English
NSC-238147
Preferred Name English
(2S)-2-[(4-{[(2-amino-4-oxo-1,4-dihydropteridin-6-yl)methyl]sulfanyl}phenyl)formamido]pentanedioic acid
Systematic Name English
10-Thiafolic acid
Common Name English
L-Glutamic acid, N-[4-[[(2-amino-1,4-dihydro-4-oxo-6-pteridinyl)methyl]thio]benzoyl]-
Systematic Name English
Code System Code Type Description
NSC
238147
Created by admin on Tue Apr 01 19:49:50 GMT 2025 , Edited by admin on Tue Apr 01 19:49:50 GMT 2025
PRIMARY
CAS
54931-98-5
Created by admin on Tue Apr 01 19:49:50 GMT 2025 , Edited by admin on Tue Apr 01 19:49:50 GMT 2025
PRIMARY
PUBCHEM
135602168
Created by admin on Tue Apr 01 19:49:50 GMT 2025 , Edited by admin on Tue Apr 01 19:49:50 GMT 2025
PRIMARY
FDA UNII
8NRE29SB6K
Created by admin on Tue Apr 01 19:49:50 GMT 2025 , Edited by admin on Tue Apr 01 19:49:50 GMT 2025
PRIMARY