N-[(2R,3S,4S,5S,6R)-6-[(2S,3S,4S,5S,6R)-5-[2,4-bis(oxidanyl)butanoylamino]-2-methoxy-6-methyl-4-oxidanyl-oxan-3-yl]oxy-5-methoxy-2-methyl-4-oxidanyl-oxan-3-yl]-2,4-bis(oxidanyl)butanamide

Systemtic Name: N-[(2R,3S,4S,5S,6R)-6-[(2S,3S,4S,5S,6R)-5-[2,4-bis(oxidanyl)butanoylamino]-2-methoxy-6-methyl-4-oxidanyl-oxan-3-yl]oxy-5-methoxy-2-methyl-4-oxidanyl-oxan-3-yl]-2,4-bis(oxidanyl)butanamide Openeye Name: N-[(2R,3S,4S,5S,6R)-6-[(2S,3S,4S,5S,6R)-5-(2,4-dihydroxybutanoylamino)-4-hydroxy-2-methoxy-6-methyl-tetrahydropyran-3-yl]oxy-4-hydroxy-5-methoxy-2-methyl-tetrahydropyran-3-yl]-2,4-dihydroxy-butanamide CAS Name: N-[(2R,3S,4S,5S,6R)-6-[[(2S,3S,4S,5S,6R)-5-[(2,4-dihydroxy-1-oxobutyl)amino]-4-hydroxy-2-methoxy-6-methyl-3-oxanyl]oxy]-4-hydroxy-5-methoxy-2-methyl-3-oxanyl]-2,4-dihydroxybutanamide IUPAC Name: N-[(2R,3S,4S,5S,6R)-6-[(2S,3S,4S,5S,6R)-5-(2,4-dihydroxybutanoylamino)-4-hydroxy-2-methoxy-6-methyloxan-3-yl]oxy-4-hydroxy-5-methoxy-2-methyloxan-3-yl]-2,4-dihydroxybutanamide Traditional Name: N-[(2R,3S,4S,5S,6R)-6-[(2S,3S,4S,5S,6R)-5-(2,4-dihydroxybutanoylamino)-4-hydroxy-2-methoxy-6-methyl-tetrahydropyran-3-yl]oxy-4-hydroxy-5-methoxy-2-methyl-tetrahydropyran-3-yl]-2,4-dihydroxy-butyramide Formula: C22H40N2O13 MolecularWeight: 540.5586

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC2C(C(C(OC2OC)C)NC(=O)C(CCO)O)O)OC)O)NC(=O)C(CCO)O

Isomeric SMILES

C[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O[C@H]2[C@H]([C@@H]([C@H](O[C@@H]2OC)C)NC(=O)C(CCO)O)O)OC)O)NC(=O)C(CCO)O

InChI

InChI=1S/C22H40N2O13/c1-9-14(24-20(32)12(28)6-8-26)16(30)18(21(34-4)35-9)37-22-17(33-3)15(29)13(10(2)36-22)23-19(31)11(27)5-7-25/h9-18,21-22,25-30H,5-8H2,1-4H3,(H,23,31)(H,24,32)/t9-,10-,11?,12?,13-,14-,15+,16+,17+,18+,21+,22-/m1/s1