(E,2R,3R,4S,5R)-2-methoxy-8-methyl-3,4,5-tris(oxidanyl)-N-[(3S,6S)-6-oxidanyl-2-oxidanylidene-azepan-3-yl]non-6-enamide

Systemtic Name: (E,2R,3R,4S,5R)-2-methoxy-8-methyl-3,4,5-tris(oxidanyl)-N-[(3S,6S)-6-oxidanyl-2-oxidanylidene-azepan-3-yl]non-6-enamide Openeye Name: (E,2R,3R,4S,5R)-3,4,5-trihydroxy-N-[(3S,6S)-6-hydroxy-2-oxo-azepan-3-yl]-2-methoxy-8-methyl-non-6-enamide CAS Name: (E,2R,3R,4S,5R)-3,4,5-trihydroxy-N-[(3S,6S)-6-hydroxy-2-oxo-3-azepanyl]-2-methoxy-8-methyl-6-nonenamide IUPAC Name: (E,2R,3R,4S,5R)-3,4,5-trihydroxy-N-[(3S,6S)-6-hydroxy-2-oxoazepan-3-yl]-2-methoxy-8-methylnon-6-enamide Traditional Name: (E,2R,3R,4S,5R)-3,4,5-trihydroxy-N-[(3S,6S)-6-hydroxy-2-keto-azepan-3-yl]-2-methoxy-8-methyl-non-6-enamide Formula: C17H30N2O7 MolecularWeight: 374.4293

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=CC(C(C(C(C(=O)NC1CCC(CNC1=O)O)OC)O)O)O

Isomeric SMILES

CC(C)/C=C/[C@H]([C@@H]([C@H]([C@H](C(=O)N[C@H]1CC[C@@H](CNC1=O)O)OC)O)O)O

InChI

InChI=1S/C17H30N2O7/c1-9(2)4-7-12(21)13(22)14(23)15(26-3)17(25)19-11-6-5-10(20)8-18-16(11)24/h4,7,9-15,20-23H,5-6,8H2,1-3H3,(H,18,24)(H,19,25)/b7-4+/t10-,11-,12+,13-,14+,15+/m0/s1