(2S,3S,4S,5S,6R)-5-(9H-carbazol-4-yloxy)-6-ethoxy-3,4,5-tris(oxidanyl)-6-[(propan-2-ylamino)methyl]oxane-2-carboxylic acid

Systemtic Name: (2S,3S,4S,5S,6R)-5-(9H-carbazol-4-yloxy)-6-ethoxy-3,4,5-tris(oxidanyl)-6-[(propan-2-ylamino)methyl]oxane-2-carboxylic acid Openeye Name: (2S,3S,4S,5S,6R)-5-(9H-carbazol-4-yloxy)-6-ethoxy-3,4,5-trihydroxy-6-[(isopropylamino)methyl]tetrahydropyran-2-carboxylic acid CAS Name: (2S,3S,4S,5S,6R)-5-(9H-carbazol-4-yloxy)-6-ethoxy-3,4,5-trihydroxy-6-[(propan-2-ylamino)methyl]-2-oxanecarboxylic acid IUPAC Name: (2S,3S,4S,5S,6R)-5-(9H-carbazol-4-yloxy)-6-ethoxy-3,4,5-trihydroxy-6-[(propan-2-ylamino)methyl]oxane-2-carboxylic acid Traditional Name: (2S,3S,4S,5S,6R)-5-(9H-carbazol-4-yloxy)-6-ethoxy-3,4,5-trihydroxy-6-[(isopropylamino)methyl]tetrahydropyran-2-carboxylic acid Formula: C24H30N2O8 MolecularWeight: 474.5036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(C(C(C(C(O1)C(=O)O)O)O)(O)OC2=CC=CC3=C2C4=CC=CC=C4N3)CNC(C)C

Isomeric SMILES

CCO[C@]1([C@@]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)(O)OC2=CC=CC3=C2C4=CC=CC=C4N3)CNC(C)C

InChI

InChI=1S/C24H30N2O8/c1-4-32-23(12-25-13(2)3)24(31,21(28)19(27)20(34-23)22(29)30)33-17-11-7-10-16-18(17)14-8-5-6-9-15(14)26-16/h5-11,13,19-21,25-28,31H,4,12H2,1-3H3,(H,29,30)/t19-,20+,21+,23-,24+/m1/s1