(2R,3R,4S,5S,6R)-3,5-dihydroxy-2-(((Z)-4-hydroxy-3-((E)-1-hydroxy-2-(morpholinoimino)ethoxy)-1-(morpholinoimino)butan-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl acetate

• ChemBase ID: 188063
• Molecular Formular: C22H38N4O12
• Molecular Mass: 550.55672
• Monoisotopic Mass: 550.24862268
• SMILES: C1(C(C(OC(C1O)CO)OC(/C=N\N1CCOCC1)C(OC(/C=N/N1CCOCC1)O)CO)O)OC(=O)C
• Canonical SMILES: OCC(C(OC1OC(CO)C(C(C1O)OC(=O)C)O)/C=N\N1CCOCC1)OC(/C=N/N1CCOCC1)O
• InChI: InChI=1S/C22H38N4O12/c1-14(29)35-21-19(31)17(13-28)38-22(20(21)32)37-15(10-23-25-2-6-33-7-3-25)16(12-27)36-18(30)11-24-26-4-8-34-9-5-26/h10-11,15-22,27-28,30-32H,2-9,12-13H2,1H3/b23-10-,24-11+
• InChIKey: ZMWARVOCEWFNNR-AQYLCCQOSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2R,3R,4S,5S,6R)-3,5-dihydroxy-2-(((Z)-4-hydroxy-3-((E)-1-hydroxy-2-(morpholinoimino)ethoxy)-1-(morpholinoimino)butan-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl acetate
• IUPAC Traditional name: (2R,3R,4S,5S,6R)-3,5-dihydroxy-2-(((Z)-4-hydroxy-3-((E)-1-hydroxy-2-(morpholinoimino)ethoxy)-1-(morpholinoimino)butan-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl acetate

Database IDs

• PubChem SID: 164243973
• PubChem CID: 16396955

CALCULATED PROPERTIES

• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Description: Polymer, n=50-52
• Classification: Rare Derivatives of Natural Compounds