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Chemical structure of Tenuifoliside C

GC37763

Tenuifoliside C

Also known as [(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2S,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)-3-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxyoxolan-2-yl]oxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate

Tenuifoliside C, isolated from polygala tenuifolia willd, significantly inhibits chlorzoxazone 6-hydroxylation catalyzed by CYP2E1

ChemicalCAS139726-37-7MW768.71FormulaC35H44O19
CAS number
139726-37-7
Molecular weight
768.71
Formula
C35H44O19
Solubility
Soluble in DMSO
InChIKey
PMGMZCFZCYRJAG-KQTMLTHJSA-N
Catalogue number
GC37763
Brand
GLPBIO
Computed properties PubChem CID 11968391 · XLogP -0.2 · TPSA 268 Ų · H-bond donors 7
XLogP
-0.2
TPSA
268 Ų
H-bond donors
7
H-bond acceptors
19
Rotatable bonds
18
Heavy atoms
54

SMILES COC1=CC(=CC(=C1O)OC)/C=C/C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O[C@]3([C@H]([C@@H]([C@H](O3)CO)O)OC(=O)/C=C/C4=CC(=C(C(=C4)OC)OC)OC)CO)O)O)O

Computed descriptors from PubChem (CID 11968391), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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