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

• ChemBase ID: 188110
• Molecular Formular: C28H36N2O12
• Molecular Mass: 592.59164
• Monoisotopic Mass: 592.2268246
• SMILES: C1(C(C(OC(C1O)CO)OC(C(OC(/C=N/Cc1ccc(cc1)O)O)CO)/C=N\Cc1ccc(cc1)O)O)OC(=O)C
• Canonical SMILES: OCC(C(OC1OC(CO)C(C(C1O)OC(=O)C)O)/C=N\Cc1ccc(cc1)O)OC(/C=N/Cc1ccc(cc1)O)O
• InChI: InChI=1S/C28H36N2O12/c1-16(33)39-27-25(37)23(15-32)42-28(26(27)38)41-21(12-29-10-17-2-6-19(34)7-3-17)22(14-31)40-24(36)13-30-11-18-4-8-20(35)9-5-18/h2-9,12-13,21-28,31-32,34-38H,10-11,14-15H2,1H3/b29-12-,30-13+
• InChIKey: UWFWSQHRVYTYOV-UQTTYRPXSA-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-((4-hydroxybenzyl)imino)ethoxy)-1-((4-hydroxybenzyl)imino)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-((4-hydroxybenzyl)imino)ethoxy)-1-((4-hydroxybenzyl)imino)butan-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl acetate

Database IDs

• PubChem SID: 164244020
• PubChem CID: 3288743

CALCULATED PROPERTIES

• Lipinski's Rule of Five: false

PROPERTIES

Product Information

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