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Chemical structure of Camelliaside A

GC35599

Camelliaside A

Also known as 5,7-dihydroxy-3-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2-(4-hydroxyphenyl)chromen-4-one

Camelliaside A is a flavonoid from the methanol extract of tea (Camellia oleifera) seed pomace

ChemicalCAS135095-52-2MW756.66FormulaC33H40O20
CAS number
135095-52-2
Molecular weight
756.66
Formula
C33H40O20
Solubility
DMSO ： 100 mg/mL (132·16 mM; Need ultrasonic)
InChIKey
WSDPAECYOJCNFT-XAGFQBSHSA-N
Catalogue number
GC35599
Brand
GLPBIO
Computed properties PubChem CID 5748475 · XLogP -2 · TPSA 324 Ų · H-bond donors 12
XLogP
-2
TPSA
324 Ų
H-bond donors
12
H-bond acceptors
20
Rotatable bonds
9
Heavy atoms
53

SMILES C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2[C@@H]([C@H](O[C@@H]([C@@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O)OC4=C(OC5=CC(=CC(=C5C4=O)O)O)C6=CC=C(C=C6)O)CO)O)O)O)O

Computed descriptors from PubChem (CID 5748475), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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