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Chemical structure of Bartsioside

GC76289

Bartsioside

Also known as (2S,3R,4S,5S,6R)-2-[[(1S,4aS,7aR)-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Bartsioside is an anti-inflammatory agent which can be extracted from C· deserticola

ChemicalCAS62133-72-6MW330.33FormulaC15H22O8
CAS number
62133-72-6
Molecular weight
330.33
Formula
C15H22O8
Solubility
H2O： 100 mg/mL (302·73 mM; Need ultrasonic)
InChIKey
FCHJZJFIDNMNBS-DNRYLMBSSA-N
Catalogue number
GC76289
Brand
GLPBIO
Computed properties PubChem CID 14081907 · XLogP -1.9 · TPSA 129 Ų · H-bond donors 5
XLogP
-1.9
TPSA
129 Ų
H-bond donors
5
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
23

SMILES C1C=C([C@H]2[C@@H]1C=CO[C@H]2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)CO

Computed descriptors from PubChem (CID 14081907), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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