2-[1-[(5-azanyl-6-oxidanyl-6-oxidanylidene-hexanoyl)amino]-2-oxidanyl-2-oxidanylidene-ethyl]-5-methanoyl-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid

Systemtic Name: 2-[1-[(5-azanyl-6-oxidanyl-6-oxidanylidene-hexanoyl)amino]-2-oxidanyl-2-oxidanylidene-ethyl]-5-methanoyl-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid Openeye Name: 2-[1-[(5-amino-6-hydroxy-6-oxo-hexanoyl)amino]-2-hydroxy-2-oxo-ethyl]-5-formyl-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid CAS Name: 2-[1-[(5-amino-6-hydroxy-1,6-dioxohexyl)amino]-2-hydroxy-2-oxoethyl]-5-formyl-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid IUPAC Name: 2-[1-[(5-amino-6-hydroxy-6-oxohexanoyl)amino]-2-hydroxy-2-oxoethyl]-5-formyl-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid Traditional Name: 2-[1-[(5-amino-6-hydroxy-6-keto-hexanoyl)amino]-2-hydroxy-2-keto-ethyl]-5-formyl-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid Formula: C14H19N3O8S MolecularWeight: 389.38096

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(NC(S1)C(C(=O)O)NC(=O)CCCC(C(=O)O)N)C(=O)O)C=O

Isomeric SMILES

C1C(=C(NC(S1)C(C(=O)O)NC(=O)CCCC(C(=O)O)N)C(=O)O)C=O

InChI

InChI=1S/C14H19N3O8S/c15-7(12(20)21)2-1-3-8(19)16-10(14(24)25)11-17-9(13(22)23)6(4-18)5-26-11/h4,7,10-11,17H,1-3,5,15H2,(H,16,19)(H,20,21)(H,22,23)(H,24,25)