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TORMENTIC-ACID-BETA-D-GLUCOPYRANOSYLESTER
SpectraBase Compound ID 4UKy8iK0XWa
InChI InChI=1S/C36H58O10/c1-18-10-13-36(30(43)46-29-26(41)25(40)24(39)21(17-37)45-29)15-14-33(5)19(27(36)35(18,7)44)8-9-23-32(4)16-20(38)28(42)31(2,3)22(32)11-12-34(23,33)6/h8,18,20-29,37-42,44H,9-17H2,1-7H3/t18-,20-,21-,22+,23-,24-,25+,26-,27-,28+,29+,32+,33-,34-,35-,36+/m1/s1
InChIKey MLKQAGPAYHTNQQ-BRDPIYJESA-N
Mol Weight 650.9 g/mol
Molecular Formula C36H58O10
Exact Mass 650.402998 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ARgNQlXS9K1
Name 2-ALPHA,3-ALPHA,19-ALPHA-TRIHYDROXY-URS-12-EN-28-OIC-ACID-BETA-D-GLUCOPYRANOSYLESTER
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H58O10
InChI InChI=1S/C36H58O10/c1-18-10-13-36(30(43)46-29-26(41)25(40)24(39)21(17-37)45-29)15-14-33(5)19(27(36)35(18,7)44)8-9-23-32(4)16-20(38)28(42)31(2,3)22(32)11-12-34(23,33)6/h8,18,20-29,37-42,44H,9-17H2,1-7H3/t18-,20-,21-,22+,23-,24-,25+,26-,27-,28+,29+,32+,33-,34-,35-,36+/m1/s1
InChIKey MLKQAGPAYHTNQQ-BRDPIYJESA-N
Literature Reference Author Z.J.JIA,X.Q.LIU,Z.M.LIU
Literature Reference Citation PHYTOCHEM.,32,155(1993)
Literature Reference DOI 10.1016/0031-9422(92)80123-V
Molecular Weight 650.851 g/mol
Solvent C5D5N
Source File Reference UWMS3569