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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H20N2O6S
Molecular Weight 368.405
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Carboxy-5,5-dimethyl-α-[(2-phenoxyacetyl)amino]-2-thiazolidineacetic acid, (αR,2R,4S)-

SMILES

[H][C@]1(N[C@@H](C(O)=O)C(C)(C)S1)[C@H](NC(=O)COC2=CC=CC=C2)C(O)=O

InChI

InChIKey=FJTUHYOOCYRLJI-RWMBFGLXSA-N
InChI=1S/C16H20N2O6S/c1-16(2)12(15(22)23)18-13(25-16)11(14(20)21)17-10(19)8-24-9-6-4-3-5-7-9/h3-7,11-13,18H,8H2,1-2H3,(H,17,19)(H,20,21)(H,22,23)/t11-,12-,13+/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H20N2O6S
Molecular Weight 368.405
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:34:57 GMT 2023
Edited
by admin
on Sat Dec 16 19:34:57 GMT 2023
Record UNII
NZ5SA3RU9Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Carboxy-5,5-dimethyl-α-[(2-phenoxyacetyl)amino]-2-thiazolidineacetic acid, (αR,2R,4S)-
Systematic Name English
2-Thiazolidineacetic acid, 4-carboxy-5,5-dimethyl-α-[(2-phenoxyacetyl)amino]-, (αR,2R,4S)-
Systematic Name English
Code System Code Type Description
FDA UNII
NZ5SA3RU9Q
Created by admin on Sat Dec 16 19:34:57 GMT 2023 , Edited by admin on Sat Dec 16 19:34:57 GMT 2023
PRIMARY
PUBCHEM
6914606
Created by admin on Sat Dec 16 19:34:57 GMT 2023 , Edited by admin on Sat Dec 16 19:34:57 GMT 2023
PRIMARY
CAS
123314-55-6
Created by admin on Sat Dec 16 19:34:57 GMT 2023 , Edited by admin on Sat Dec 16 19:34:57 GMT 2023
PRIMARY
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