2-{1-[2-Amino-2-(4-Hydroxy-Phenyl)-Acetylamino]-2-Oxo-Ethyl}-5,5-Dimethyl-Thiazolidine-4-Carboxylic Acid (Q27094576)

2-{1-[2-AMINO-2-(4-HYDROXY-PHENYL)-ACETYLAMINO]-2-OXO-ETHYL}-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID (English)

(2R,4S)-2-[(1R)-1-[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid

4 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₆H₂₁N₃O₅S

1 reference

2-{1-[2-AMINO-2-(4-HYDROXY-PHENYL)-ACETYLAMINO]-2-OXO-ETHYL}-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID (English)

4 October 2016

canonical SMILES

CC1(C(NC(S1)C(C=O)NC(=O)C(C2=CC=C(C=C2)O)N)C(=O)O)C

1 reference

2-{1-[2-AMINO-2-(4-HYDROXY-PHENYL)-ACETYLAMINO]-2-OXO-ETHYL}-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID (English)

4 October 2016

isomeric SMILES

CC1([C@@H](N[C@@H](S1)[C@H](C=O)NC(=O)[C@H](C2=CC=C(C=C2)O)N)C(=O)O)C

1 reference

2-{1-[2-AMINO-2-(4-HYDROXY-PHENYL)-ACETYLAMINO]-2-OXO-ETHYL}-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID (English)

InChI=1S/C16H21N3O5S/c1-16(2)12(15(23)24)19-14(25-16)10(7-20)18-13(22)11(17)8-3-5-9(21)6-4-8/h3-7,10-12,14,19,21H,17H2,1-2H3,(H,18,22)(H,23,24)/t10-,11-,12-,14-/m0/s1

4 October 2016

Identifiers

InChI

1 reference

2-{1-[2-AMINO-2-(4-HYDROXY-PHENYL)-ACETYLAMINO]-2-OXO-ETHYL}-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID (English)

SMLJDSWXGVMNTH-MNXVOIDGSA-N

4 October 2016

InChIKey

1 reference

2-{1-[2-AMINO-2-(4-HYDROXY-PHENYL)-ACETYLAMINO]-2-OXO-ETHYL}-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID (English)

4 October 2016

1 reference

(2S,4S)-2-(1-{[(2S)-2-Amino-2-(4-hydroxyphenyl)acetyl]amino}-2-oxoethyl)-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid (English)

4 October 2016

2 references

2-{1-[2-AMINO-2-(4-HYDROXY-PHENYL)-ACETYLAMINO]-2-OXO-ETHYL}-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID (English)