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Chemical structure of Pueraria glycoside 2

GC37038

Pueraria glycoside 2

Also listed as Puerarin 6''-O-Xyloside

Puerarin 6''-O-Xyloside, isolated from radix of Pueraria lobata (Willd

ChemicalCAS114240-18-5MW548.49FormulaC26H28O13
CAS number
114240-18-5
Molecular weight
548.49
Formula
C26H28O13
Solubility
DMSO ： 100 mg/mL (182·32 mM; Need ultrasonic)
InChIKey
YCFQXQCEEPCZMO-KATYHMCLSA-N
Catalogue number
GC37038
Brand
GLPBIO
Computed properties PubChem CID 100990912 · XLogP -2.1 · TPSA 216 Ų · H-bond donors 8
XLogP
-2.1
TPSA
216 Ų
H-bond donors
8
H-bond acceptors
13
Rotatable bonds
5
Heavy atoms
39

SMILES C1[C@H]([C@@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)C3=C(C=CC4=C3OC=C(C4=O)C5=CC=C(C=C5)O)O)O)O)O)O)O)O

Computed descriptors from PubChem (CID 100990912), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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