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3-O-BETA-GLUCURONOPYRANOSYL-HEDERAGENIN
SpectraBase Compound ID ALxPR1N6zPn
InChI InChI=1S/C36H56O10/c1-31(2)13-15-36(30(43)44)16-14-34(5)19(20(36)17-31)7-8-22-32(3)11-10-23(33(4,18-37)21(32)9-12-35(22,34)6)45-29-26(40)24(38)25(39)27(46-29)28(41)42/h7,20-27,29,37-40H,8-18H2,1-6H3,(H,41,42)(H,43,44)/t20?,21?,22?,23-,24-,25-,26+,27-,29+,32-,33-,34+,35+,36-/m0/s1
InChIKey DYFUVQSGLMQLRX-XREANNPSSA-N
Mol Weight 648.8 g/mol
Molecular Formula C36H56O10
Exact Mass 648.387348 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DczGZPeRxhK
Name 3-O-BETA-GLUCURONOPYRANOSYL-HEDERAGENIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H56O10
InChI InChI=1S/C36H56O10/c1-31(2)13-15-36(30(43)44)16-14-34(5)19(20(36)17-31)7-8-22-32(3)11-10-23(33(4,18-37)21(32)9-12-35(22,34)6)45-29-26(40)24(38)25(39)27(46-29)28(41)42/h7,20-27,29,37-40H,8-18H2,1-6H3,(H,41,42)(H,43,44)/t20?,21?,22?,23-,24-,25-,26+,27-,29+,32-,33-,34+,35+,36-/m0/s1
InChIKey DYFUVQSGLMQLRX-XREANNPSSA-N
Literature Reference Author N.TAN,J.ZHOU,S.ZHAO
Literature Reference Citation PHYTOCHEM.,52,153(1999)
Literature Reference DOI 10.1016/S0031-9422(98)00454-3
Molecular Weight 648.835 g/mol
Solvent C5D5N
Source File Reference UWVN1134