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Chemical structure of Triptolide palmitate

GC73782

Triptolide palmitate

Also known as [(1S,2S,4S,5S,7S,8R,9R,11S,13S)-1-methyl-17-oxo-7-propan-2-yl-3,6,10,16-tetraoxaheptacyclo[11.7.0.02,4.02,9.05,7.09,11.014,18]icos-14(18)-en-8-yl] hexadecanoate

Triptolide palmitate is the derivative of Triptolide

ChemicalCAS2126920-51-0MW598.81FormulaC36H54O7
CAS number
2126920-51-0
Molecular weight
598.81
Formula
C36H54O7
Solubility
DMSO ： 100 mg/mL (167·00 mM; Need ultrasonic)
InChIKey
IQUZWSRBSSSQQN-JMZYWKSWSA-N
Catalogue number
GC73782
Brand
GLPBIO
Computed properties PubChem CID 171714238 · XLogP 8.1 · TPSA 90.2 Ų · H-bond donors 0
XLogP
8.1
TPSA
90.2 Ų
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
17
Heavy atoms
43

SMILES CCCCCCCCCCCCCCCC(=O)O[C@H]1[C@@]23[C@@H](O2)C[C@H]4C5=C(CC[C@@]4([C@]36[C@@H](O6)[C@H]7[C@@]1(O7)C(C)C)C)C(=O)OC5

Computed descriptors from PubChem (CID 171714238), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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