2-azanyl-3-[2-(carboxymethyl)-2,5-bis(oxidanyl)cyclohex-3-en-1-yl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-(carboxymethyl)-2,5-bis(oxidanyl)cyclohex-3-en-1-yl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-(carboxymethyl)-2,5-dihydroxy-cyclohex-3-en-1-yl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-(carboxymethyl)-2,5-dihydroxy-1-cyclohex-3-enyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-(carboxymethyl)-2,5-dihydroxycyclohex-3-en-1-yl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-(carboxymethyl)-2,5-dihydroxy-cyclohex-3-en-1-yl]thio]propionic acid Formula: C11H17NO6S MolecularWeight: 291.32078

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CC(C1SCC(C(=O)O)N)(CC(=O)O)O)O

Isomeric SMILES

C1C(C=CC(C1SCC(C(=O)O)N)(CC(=O)O)O)O

InChI

InChI=1S/C11H17NO6S/c12-7(10(16)17)5-19-8-3-6(13)1-2-11(8,18)4-9(14)15/h1-2,6-8,13,18H,3-5,12H2,(H,14,15)(H,16,17)