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2,3-DIACETOXY-TORMENTIC-ACID;2-ALPHA,3-BETA,19-ALPHA-TRIHYDROXY-URS-12-EN-28-OIC-ACID-DIACETATE
SpectraBase Compound ID 8oqdD7P9jd3
InChI InChI=1S/C34H52O7/c1-19-12-15-34(28(37)38)17-16-31(7)22(26(34)33(19,9)39)10-11-25-30(6)18-23(40-20(2)35)27(41-21(3)36)29(4,5)24(30)13-14-32(25,31)8/h10,19,23-27,39H,11-18H2,1-9H3,(H,37,38)/t19-,23-,24?,25?,26-,27+,30+,31-,32-,33-,34+/m1/s1
InChIKey APYZMQOFHXDIQV-KZFLFIBMSA-N
Mol Weight 572.8 g/mol
Molecular Formula C34H52O7
Exact Mass 572.371304 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DIGubd8Hqzg
Name 2,3-DIACETOXY-TORMENTIC-ACID;2-ALPHA,3-BETA,19-ALPHA-TRIHYDROXY-URS-12-EN-28-OIC-ACID-DIACETATE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H52O7
InChI InChI=1S/C34H52O7/c1-19-12-15-34(28(37)38)17-16-31(7)22(26(34)33(19,9)39)10-11-25-30(6)18-23(40-20(2)35)27(41-21(3)36)29(4,5)24(30)13-14-32(25,31)8/h10,19,23-27,39H,11-18H2,1-9H3,(H,37,38)/t19-,23-,24?,25?,26-,27+,30+,31-,32-,33-,34+/m1/s1
InChIKey APYZMQOFHXDIQV-KZFLFIBMSA-N
Literature Reference Author C.TERREAUX,M.P.MAILLARD,M.P.GUPTA,K.HOSTETTMANN
Literature Reference Citation PHYTOCHEM.,42,495(1996)
Literature Reference DOI 10.1016/0031-9422(95)00945-0
Molecular Weight 572.783 g/mol
Solvent C5D5N