(2S,3R)-3-cyclohexyl-N-[(E)-[1-[[(2R,3R,4R,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)pyrrolidin-2-yl]methyl]-1,2,3-triazol-4-yl]methylideneamino]-2,3-bis(oxidanyl)propanamide

Systemtic Name: (2S,3R)-3-cyclohexyl-N-[(E)-[1-[[(2R,3R,4R,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)pyrrolidin-2-yl]methyl]-1,2,3-triazol-4-yl]methylideneamino]-2,3-bis(oxidanyl)propanamide Openeye Name: (2S,3R)-3-cyclohexyl-N-[(E)-[1-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]methyl]triazol-4-yl]methyleneamino]-2,3-dihydroxy-propanamide CAS Name: (2S,3R)-3-cyclohexyl-N-[(E)-[1-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-pyrrolidinyl]methyl]-4-triazolyl]methylideneamino]-2,3-dihydroxypropanamide IUPAC Name: (2S,3R)-3-cyclohexyl-N-[(E)-[1-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]methyl]triazol-4-yl]methylideneamino]-2,3-dihydroxypropanamide Traditional Name: (2S,3R)-3-cyclohexyl-N-[(E)-[1-[[(2R,3R,4R,5R)-3,4-dihydroxy-5-methylol-pyrrolidin-2-yl]methyl]triazol-4-yl]methyleneamino]-2,3-dihydroxy-propionamide Formula: C18H30N6O6 MolecularWeight: 426.4674

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(C(=O)NN=CC2=CN(N=N2)CC3C(C(C(N3)CO)O)O)O)O

Isomeric SMILES

C1CCC(CC1)[C@H]([C@@H](C(=O)N/N=C/C2=CN(N=N2)C[C@@H]3[C@H]([C@@H]([C@H](N3)CO)O)O)O)O

InChI

InChI=1S/C18H30N6O6/c25-9-13-16(28)15(27)12(20-13)8-24-7-11(21-23-24)6-19-22-18(30)17(29)14(26)10-4-2-1-3-5-10/h6-7,10,12-17,20,25-29H,1-5,8-9H2,(H,22,30)/b19-6+/t12-,13-,14-,15-,16-,17+/m1/s1