Chem
J-GLOBAL ID：200907001701921646   Nikkaji number：J1.291.250A

Pyochlln

ピオケルン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C14H16N2O3S2
Molecular formula furigana： C14-H16-N2-O3-S2
Molecular weight： 324.410
InChI： InChI=1S/C14H16N2O3S2/c1-16-10(14(18)19)7-21-13(16)9-6-20-12(15-9)8-4-2-3-5-11(8)17/h2-5,9-10,13,17H,6-7H2,1H3,(H,18,19)/t9-,10+,13?/m1/s1
InChI key： NYBZAGXTZXPYND-GDVCOKDOSA-N
SMILES： CN1C(SC[C@H]1C(=O)O)[C@H]1CSC(=N1)c1ccccc1O
Systematic name  (3)：
  • (4R)-2-[(4R)-4,5-ジヒドロ-2-(2-ヒドロキシフェニル)チアゾール-4-イル]-3-メチル-4-チアゾリジンカルボン酸
  • (4R)-2-[(4R)-2-(2-ヒドロキシフェニル)-4,5-ジヒドロ-1,3-チアゾール-4-イル]-3-メチル-1,3-チアゾリジン-4-カルボン酸
  • (4R)-2-[(4R)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-thiazol-4-yl]-3-methyl-1,3-thiazolidine-4-carboxylic acid
Other name (3)：
  • (4R)-2-[(4R)-4,5-Dihydro-2-(2-hydroxyphenyl)thiazole-4-yl]-3-methyl-4-thiazolidinecarboxylic acid
  • Pyochlln
  • ピオケルン
KEGG COMPOUND： C12037
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