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8-O-(12-[L-ALANINOYLAMINO]-DODECANOYL)-8-O-DEBUTANOYL-THAPSIGARGIN

Compound with spectra: 1 NMR

8-O-(12-[L-ALANINOYLAMINO]-DODECANOYL)-8-O-DEBUTANOYL-THAPSIGARGIN
SpectraBase Compound ID G2YgqhCY2z0
InChI InChI=1S/C45H72N2O13/c1-9-11-12-18-21-25-34(50)57-38-36-35(29(4)37(38)58-41(52)28(3)10-2)39-45(55,44(8,54)42(53)59-39)32(27-43(36,7)60-31(6)48)56-33(49)24-22-19-16-14-13-15-17-20-23-26-47-40(51)30(5)46/h10,30,32,36-39,54-55H,9,11-27,46H2,1-8H3,(H,47,51)/b28-10-/t30-,32-,36+,37-,38-,39-,43-,44+,45+/m0/s1
InChIKey QCRFZVFIAQWLAH-UREJSKAGSA-N
Mol Weight 849.1 g/mol
Molecular Formula C45H72N2O13
Exact Mass 848.50344 g/mol
Enantiomer InChIKey QCRFZVFIAQWLAH-ISAGZDMLSA-N

View Spectrum of 8-O-(12-[L-ALANINOYLAMINO]-DODECANOYL)-8-O-DEBUTANOYL-THAPSIGARGIN

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Design, Synthesis, and Pharmacological Evaluation of Thapsigargin Analogues for Targeting Apoptosis to Prostatic Cancer Cells Journal of Medicinal Chemistry 2001
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