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BETULINIC-ACID-3-BETA-CAFFEATE
SpectraBase Compound ID AwooFHFs50b
InChI InChI=1S/C39H54O6/c1-23(2)25-14-19-39(34(43)44)21-20-37(6)26(33(25)39)10-12-30-36(5)17-16-31(35(3,4)29(36)15-18-38(30,37)7)45-32(42)13-9-24-8-11-27(40)28(41)22-24/h8-9,11,13,22,25-26,29-31,33,40-41H,1,10,12,14-21H2,2-7H3,(H,43,44)/b13-9+/t25-,26+,29-,30+,31-,33+,36-,37+,38+,39-/m0/s1
InChIKey MNUNUJQYFJZRHQ-VZLLCJDWSA-N
Mol Weight 618.9 g/mol
Molecular Formula C39H54O6
Exact Mass 618.392039 g/mol
Enantiomer InChIKey MNUNUJQYFJZRHQ-CJLFXVPHSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent ACETONE-D6
  • 3-O-(3',4'-DIHYDROXYCINNAMOYL)-BETULINIC-ACID;PYRACRENIC-ACID
  • LUP-20(29)-EN-28-OIC-3-BETA-YL-CAFFEATE;BETULINIC-ACID-3-BETA-YL-CAFFEATE
Title Journal or Book Year
Triterpene caffeoyl esters and diterpenes from Celastrus stephanotifolius Phytochemistry 1999
Triterpene caffeates from bark of Betula pubescens Phytochemistry 1994
Lupane Triterpenoids of Salacia cordata Journal of Natural Products 1992

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