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3-O-(beta-D-GLUCOPYRANOSYL)-HEDERAGENIN
SpectraBase Compound ID BZWnL6DHROi
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-XJDUBTRDSA-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 D8LYY33AUTq
Name 3-O-(beta-D-GLUCOPYRANOSYL)-HEDERAGENIN
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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-XJDUBTRDSA-N
NMR Standard TMS
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