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HEDERAGENIN-3-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID Az1ANqUjKKy
InChI InChI=1S/C36H58O9/c1-31(2)13-15-36(30(42)43)16-14-34(5)20(21(36)17-31)7-8-24-32(3)11-10-25(33(4,19-38)23(32)9-12-35(24,34)6)45-29-28(41)27(40)26(39)22(18-37)44-29/h7,21-29,37-41H,8-19H2,1-6H3,(H,42,43)/t21-,22+,23+,24+,25-,26+,27-,28+,29-,32?,33-,34?,35?,36-/m0/s1
InChIKey CCDRPBGPIXPGRW-YJXGEHTBSA-N
Mol Weight 634.9 g/mol
Molecular Formula C36H58O9
Exact Mass 634.408083 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID sEZHRD8sqU
Name HEDERAGENIN-3-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H58O9
InChI InChI=1S/C36H58O9/c1-31(2)13-15-36(30(42)43)16-14-34(5)20(21(36)17-31)7-8-24-32(3)11-10-25(33(4,19-38)23(32)9-12-35(24,34)6)45-29-28(41)27(40)26(39)22(18-37)44-29/h7,21-29,37-41H,8-19H2,1-6H3,(H,42,43)/t21-,22+,23+,24+,25-,26+,27-,28+,29-,32?,33-,34?,35?,36-/m0/s1
InChIKey CCDRPBGPIXPGRW-YJXGEHTBSA-N
Literature Reference Author W.J.KWAK,C.K.HAN,H.W.CHANG,H.P.KIM,S.S.KANG,K.H.SON
Literature Reference Citation CHEM.PHARM.BULL.,51,333(2003)
Literature Reference DOI 10.1248/cpb.51.333
Molecular Weight 634.851 g/mol
Solvent C5D5N
Source File Reference UWMS21198