2-azanyl-3-[(5-oxidanyl-4-oxidanylidene-pyran-2-yl)methylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[(5-oxidanyl-4-oxidanylidene-pyran-2-yl)methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[(5-hydroxy-4-oxo-pyran-2-yl)methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[(5-hydroxy-4-oxo-2-pyranyl)methylthio]propanoic acid IUPAC Name: 2-amino-3-[(5-hydroxy-4-oxopyran-2-yl)methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[(5-hydroxy-4-keto-pyran-2-yl)methylthio]propionic acid Formula: C9H11NO5S MolecularWeight: 245.25234

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC=C(C1=O)O)CSCC(C(=O)O)N

Isomeric SMILES

C1=C(OC=C(C1=O)O)CSCC(C(=O)O)N

InChI

InChI=1S/C9H11NO5S/c10-6(9(13)14)4-16-3-5-1-7(11)8(12)2-15-5/h1-2,6,12H,3-4,10H2,(H,13,14)