N-[[3-azanyl-2-[6-[4,6-bis(azanyl)-2,3-bis(oxidanyl)cyclohexyl]oxy-3-methyl-4-(methylamino)-5-oxidanyl-oxan-3-yl]oxy-3,4-dihydro-2H-pyran-6-yl]methyl]ethanamide

Systemtic Name: N-[[3-azanyl-2-[6-[4,6-bis(azanyl)-2,3-bis(oxidanyl)cyclohexyl]oxy-3-methyl-4-(methylamino)-5-oxidanyl-oxan-3-yl]oxy-3,4-dihydro-2H-pyran-6-yl]methyl]ethanamide Openeye Name: N-[[3-amino-2-[6-(4,6-diamino-2,3-dihydroxy-cyclohexoxy)-5-hydroxy-3-methyl-4-(methylamino)tetrahydropyran-3-yl]oxy-3,4-dihydro-2H-pyran-6-yl]methyl]acetamide CAS Name: N-[[3-amino-2-[[6-(4,6-diamino-2,3-dihydroxycyclohexyl)oxy-5-hydroxy-3-methyl-4-(methylamino)-3-oxanyl]oxy]-3,4-dihydro-2H-pyran-6-yl]methyl]acetamide IUPAC Name: N-[[3-amino-2-[6-(4,6-diamino-2,3-dihydroxycyclohexyl)oxy-5-hydroxy-3-methyl-4-(methylamino)oxan-3-yl]oxy-3,4-dihydro-2H-pyran-6-yl]methyl]acetamide Traditional Name: N-[[3-amino-2-[6-(4,6-diamino-2,3-dihydroxy-cyclohexoxy)-5-hydroxy-3-methyl-4-(methylamino)tetrahydropyran-3-yl]oxy-3,4-dihydro-2H-pyran-6-yl]methyl]acetamide Formula: C21H39N5O8 MolecularWeight: 489.56306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CCC(C(O1)OC2(COC(C(C2NC)O)OC3C(CC(C(C3O)O)N)N)C)N

Isomeric SMILES

CC(=O)NCC1=CCC(C(O1)OC2(COC(C(C2NC)O)OC3C(CC(C(C3O)O)N)N)C)N

InChI

InChI=1S/C21H39N5O8/c1-9(27)26-7-10-4-5-11(22)19(32-10)34-21(2)8-31-20(16(30)18(21)25-3)33-17-13(24)6-12(23)14(28)15(17)29/h4,11-20,25,28-30H,5-8,22-24H2,1-3H3,(H,26,27)