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30-HYDROXY-16-EPI-SAIKOGENIN-C-3-O-BETA-GLUCOPYRANOSYL-(1->6)-[ALPHA-RHAMNOPYRANOSYL-(1->4)]-BETA-GLUCOPYRANOSIDE
SpectraBase Compound ID FpyA50KqGAT
InChI InChI=1S/C48H78O18/c1-22-31(53)33(55)37(59)41(62-22)66-39-26(19-61-40-36(58)34(56)32(54)25(18-49)63-40)64-42(38(60)35(39)57)65-30-11-12-45(5)27(43(30,2)3)10-13-46(6)28(45)9-8-23-24-16-44(4,20-50)14-15-48(24,21-51)29(52)17-47(23,46)7/h8-9,22,25-42,49-60H,10-21H2,1-7H3/t22-,25-,26-,27+,28-,29-,30+,31-,32-,33+,34+,35-,36-,37+,38-,39-,40-,41-,42+,44+,45+,46-,47-,48-/m1/s1
InChIKey HGDOWZUOWWTDPQ-CSTKSLMPSA-N
Mol Weight 943.1 g/mol
Molecular Formula C48H78O18
Exact Mass 942.518816 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5JaFnDLqB4a
Name 30-HYDROXY-16-EPI-SAIKOGENIN-C-3-O-BETA-GLUCOPYRANOSYL-(1->6)-[ALPHA-RHAMNOPYRANOSYL-(1->4)]-BETA-GLUCOPYRANOSIDE
Compound Number BK2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H78O18
InChI InChI=1S/C48H78O18/c1-22-31(53)33(55)37(59)41(62-22)66-39-26(19-61-40-36(58)34(56)32(54)25(18-49)63-40)64-42(38(60)35(39)57)65-30-11-12-45(5)27(43(30,2)3)10-13-46(6)28(45)9-8-23-24-16-44(4,20-50)14-15-48(24,21-51)29(52)17-47(23,46)7/h8-9,22,25-42,49-60H,10-21H2,1-7H3/t22-,25-,26-,27+,28-,29-,30+,31-,32-,33+,34+,35-,36-,37+,38-,39-,40-,41-,42+,44+,45+,46-,47-,48-/m1/s1
InChIKey HGDOWZUOWWTDPQ-CSTKSLMPSA-N
Literature Reference Author S.Q.LUO,H.F.JIN,H.KAWAI,H.SETO,N.OTAKE
Literature Reference Citation AGR.BIOL.CHEM.,51,1515(1987)
Literature Reference DOI 10.1271/bbb1961.51.1515
Molecular Weight 943.137 g/mol
Solvent Unknown
Source File Reference UWBT8142