Pyochelin
CAS Registry Number®
79236-62-7
CAS Name
PyochelinMolecular Formula
C14H16N2O3S2Molecular Mass
324.42Cite this Page
Pyochelin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=79236-62-7 (retrieved ) (CAS RN: 79236-62-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
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
InChIKey
InChIKey=NYBZAGXTZXPYND-GBIKHYSHSA-N
SMILES
CN1[C@](SC[C@H]1C(O)=O)([C@@]2(N=C(SC2)C3=C(O)C=CC=C3)[H])[H]
Canonical SMILES
O=C(O)C1N(C)C(SC1)C2N=C(SC2)C=3C=CC=CC3O
Other Names for this Substance
- 4-Thiazolidinecarboxylic acid, 2-[(4R)-4,5-dihydro-2-(2-hydroxyphenyl)-4-thiazolyl]-3-methyl-, (2R,4R)-
- (2R,4R)-2-[(4R)-4,5-Dihydro-2-(2-hydroxyphenyl)-4-thiazolyl]-3-methyl-4-thiazolidinecarboxylic acid
- Pyochelin
- Pyocheline
- Pyochelin I
Deleted or Replaced CAS Registry Numbers
69772-54-9, 164104-31-8