[(2R,3R,4R,5R,6S)-5-azanyl-2-(hydroxymethyl)-6-[(2S,3R,4R,5S,6S)-2-methyl-3,5-bis(oxidanyl)-6-prop-2-enoxy-oxan-4-yl]oxy-3-oxidanyl-oxan-4-yl] hydrogen sulfate

Systemtic Name: [(2R,3R,4R,5R,6S)-5-azanyl-2-(hydroxymethyl)-6-[(2S,3R,4R,5S,6S)-2-methyl-3,5-bis(oxidanyl)-6-prop-2-enoxy-oxan-4-yl]oxy-3-oxidanyl-oxan-4-yl] hydrogen sulfate Openeye Name: [(2S,3R,4R,5R,6R)-2-[(2S,3S,4R,5R,6S)-2-allyloxy-3,5-dihydroxy-6-methyl-tetrahydropyran-4-yl]oxy-3-amino-5-hydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl] hydrogen sulfate CAS Name: sulfuric acid [(2S,3R,4R,5R,6R)-3-amino-2-[[(2S,3R,4R,5S,6S)-3,5-dihydroxy-2-methyl-6-prop-2-enoxy-4-oxanyl]oxy]-5-hydroxy-6-(hydroxymethyl)-4-oxanyl] ester IUPAC Name: [(2S,3R,4R,5R,6R)-3-amino-2-[(2S,3R,4R,5S,6S)-3,5-dihydroxy-2-methyl-6-prop-2-enoxyoxan-4-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl] hydrogen sulfate Traditional Name: sulfuric acid [(2S,3R,4R,5R,6R)-2-[(2S,3S,4R,5R,6S)-2-allyloxy-3,5-dihydroxy-6-methyl-tetrahydropyran-4-yl]oxy-3-amino-5-hydroxy-6-methylol-tetrahydropyran-4-yl] ester Formula: C15H27NO12S MolecularWeight: 445.43938

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OCC=C)O)OC2C(C(C(C(O2)CO)O)OS(=O)(=O)O)N)O

Isomeric SMILES

C[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)OCC=C)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)OS(=O)(=O)O)N)O

InChI

InChI=1S/C15H27NO12S/c1-3-4-24-15-11(20)13(9(18)6(2)25-15)27-14-8(16)12(28-29(21,22)23)10(19)7(5-17)26-14/h3,6-15,17-20H,1,4-5,16H2,2H3,(H,21,22,23)/t6-,7+,8+,9+,10+,11-,12+,13+,14-,15-/m0/s1