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Chemical structure of Tribuloside

GC37825

Tribuloside

Also known as [(2R,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (Z)-3-(4-hydroxyphenyl)prop-2-enoate

Tribuloside is a flavonoid that can be isolated from Tribulus terrestris L

ChemicalCAS22153-44-2MW594.52FormulaC30H26O13
CAS number
22153-44-2
Molecular weight
594.52
Formula
C30H26O13
Solubility
DMSO ： 125 mg/mL (210·25 mM; Need ultrasonic)
InChIKey
DVGGLGXQSFURLP-PYFXTMFGSA-N
Catalogue number
GC37825
Brand
GLPBIO
Computed properties PubChem CID 10175330 · XLogP 2.5 · TPSA 213 Ų · H-bond donors 7
XLogP
2.5
TPSA
213 Ų
H-bond donors
7
H-bond acceptors
13
Rotatable bonds
8
Heavy atoms
43

SMILES C1=CC(=CC=C1/C=C\C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O

Computed descriptors from PubChem (CID 10175330), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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