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MYRICERIC-ACID-A;3-OXO-27-TRANS-CAFFEOYLOXY-OLEAN-12-EN-28-OIC-ACID
SpectraBase Compound ID 806iW0yYa2R
InChI InChI=1S/C39H52O7/c1-34(2)17-18-38(33(44)45)19-20-39(23-46-32(43)12-8-24-7-10-27(40)28(41)21-24)25(26(38)22-34)9-11-30-36(5)15-14-31(42)35(3,4)29(36)13-16-37(30,39)6/h7-10,12,21,26,29-30,40-41H,11,13-20,22-23H2,1-6H3,(H,44,45)/b12-8+/t26-,29-,30+,36-,37+,38-,39-/m0/s1
InChIKey RHAKBYCTYSBWIE-QWZNMBRFSA-N
Mol Weight 632.8 g/mol
Molecular Formula C39H52O7
Exact Mass 632.371304 g/mol
Enantiomer InChIKey RHAKBYCTYSBWIE-HNIJLUPPSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3:CD3OH=10:1
Title Journal or Book Year
Endothelin Receptor Antagonist Triterpenoid, Myriceric Acid A, Isolated from Myrica cerifera, and Structure Activity Relationships of Its Derivatives. Chemical and Pharmaceutical Bulletin 1996

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