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(2R,3R,4R,5S,6R)-6-(acetoxymethyl)-2-(((2R,3R,4S,5R,6R)-4,5-diacetoxy-2-(acetoxymethyl)-6-hydroxytetrahydro-2H-pyran-3-yl)oxy)-5-hydroxytetrahydro-2H-pyran-3,4-diyl diacetate
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ChemBase ID:
184174
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Molecular Formular:
C24H34O17
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Molecular Mass:
594.51656
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Monoisotopic Mass:
594.17959963
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SMILES and InChIs
SMILES:
C1(C(C(C(OC1OC1C(C(C(OC1COC(=O)C)O)OC(=O)C)OC(=O)C)COC(=O)C)O)OC(=O)C)OC(=O)C
Canonical SMILES:
CC(=O)OCC1OC(OC2C(COC(=O)C)OC(C(C2OC(=O)C)OC(=O)C)O)C(C(C1O)OC(=O)C)OC(=O)C
InChI:
InChI=1S/C24H34O17/c1-9(25)33-7-15-17(31)19(35-11(3)27)22(38-14(6)30)24(40-15)41-18-16(8-34-10(2)26)39-23(32)21(37-13(5)29)20(18)36-12(4)28/h15-24,31-32H,7-8H2,1-6H3
InChIKey:
LILBYIPNRVSZHK-UHFFFAOYSA-N
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Cite this record
CBID:184174 http://www.chembase.cn/molecule-184174.html
NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
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IUPAC name
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(2R,3R,4R,5S,6R)-6-(acetoxymethyl)-2-(((2R,3R,4S,5R,6R)-4,5-diacetoxy-2-(acetoxymethyl)-6-hydroxytetrahydro-2H-pyran-3-yl)oxy)-5-hydroxytetrahydro-2H-pyran-3,4-diyl diacetate
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IUPAC Traditional name
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(2R,3R,4R,5S,6R)-6-(acetoxymethyl)-2-(((2R,3R,4S,5R,6R)-4,5-diacetoxy-2-(acetoxymethyl)-6-hydroxytetrahydro-2H-pyran-3-yl)oxy)-5-hydroxytetrahydro-2H-pyran-3,4-diyl diacetate
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
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Lipinski's Rule of Five
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false
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PROPERTIES
PROPERTIES
Product Information
Bioassay(PubChem)
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Description
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Polymer, n=8-9
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Show
data source
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Classification
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Rare Derivatives of Natural Compounds
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Show
data source
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PATENTS
PATENTS
PubChem Patent
Google Patent