8PO
(2R)-2-(4-hydroxyphenyl)-2-[[(2S)-2-methyl-3-sulfanyl-propanoyl]amino]ethanoic acid
Find entries where: 8PO
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | (2R)-2-(4-hydroxyphenyl)-2-[[(2S)-2-methyl-3-sulfanyl-propanoyl]amino]ethanoic acid |
Synonyms | (R)-2-(4-hydroxyphenyl)-2-((S)-3-mercapto-2-methylpropanamido)acetic acid |
Identifiers | (2~{R})-2-(4-hydroxyphenyl)-2-[[(2~{S})-2-methyl-3-sulfanyl-propanoyl]amino]ethanoic acid |
Formula | C12 H15 N O4 S |
Molecular Weight | 269.317 |
Type | NON-POLYMER |
Isomeric SMILES | C[C@H](CS)C(=O)N[C@H](c1ccc(cc1)O)C(=O)O |
InChI | InChI=1S/C12H15NO4S/c1-7(6-18)11(15)13-10(12(16)17)8-2-4-9(14)5-3-8/h2-5,7,10,14,18H,6H2,1H3,(H,13,15)(H,16,17)/t7-,10-/m1/s1 |
InChIKey | XFVAHOYBWXJSDW-GMSGAONNSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 33 |
Chiral Atom Count | 2 |
Bond Count | 33 |
Aromatic Bond Count | 6 |
Related Resource References
Resource Name | Reference |
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PubChem | 132274395 |
ChEMBL | CHEMBL4167648 |