14-methoxy-16-oxidanyl-11-oxidanylidene-7-sulfanylidene-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxylic acid

Systemtic Name: 14-methoxy-16-oxidanyl-11-oxidanylidene-7-sulfanylidene-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxylic acid Openeye Name: 16-hydroxy-14-methoxy-11-oxo-7-thioxo-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxylic acid CAS Name: 16-hydroxy-14-methoxy-11-oxo-7-sulfanylidene-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxylic acid IUPAC Name: 16-hydroxy-14-methoxy-11-oxo-7-sulfanylidene-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxylic acid Traditional Name: 16-hydroxy-11-keto-14-methoxy-7-thioxo-10-oxa-3-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxylic acid Formula: C15H17NO6S2 MolecularWeight: 371.42858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2CSCC(NC(=S)CCOC(=O)C2=C1)C(=O)O)O

Isomeric SMILES

COC1=CC(=C2CSCC(NC(=S)CCOC(=O)C2=C1)C(=O)O)O

InChI

InChI=1S/C15H17NO6S2/c1-21-8-4-9-10(12(17)5-8)6-24-7-11(14(18)19)16-13(23)2-3-22-15(9)20/h4-5,11,17H,2-3,6-7H2,1H3,(H,16,23)(H,18,19)