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TAIBAIENOSIDE-VI;OLEANOLIC-ACID-3-O-[BETA-D-XYLOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->3)]-BETA-D-GLUCURONOPYRANOSIDE
SpectraBase Compound ID 9yjfWCssU9B
InChI InChI=1S/C47H74O18/c1-42(2)14-16-47(41(58)59)17-15-45(6)21(22(47)18-42)8-9-26-44(5)12-11-27(43(3,4)25(44)10-13-46(26,45)7)62-40-36(65-38-31(53)28(50)23(49)20-60-38)34(33(55)35(64-40)37(56)57)63-39-32(54)30(52)29(51)24(19-48)61-39/h8,22-36,38-40,48-55H,9-20H2,1-7H3,(H,56,57)(H,58,59)/t22-,23+,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,35-,36+,38-,39-,40+,44-,45+,46+,47-/m0/s1
InChIKey DPXMETKXNWBGRI-HHAITRAOSA-N
Mol Weight 927.1 g/mol
Molecular Formula C47H74O18
Exact Mass 926.487516 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1lzsGbiC6dq
Name TAIBAIENOSIDE-VI;OLEANOLIC-ACID-3-O-[BETA-D-XYLOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->3)]-BETA-D-GLUCURONOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C47H74O18
InChI InChI=1S/C47H74O18/c1-42(2)14-16-47(41(58)59)17-15-45(6)21(22(47)18-42)8-9-26-44(5)12-11-27(43(3,4)25(44)10-13-46(26,45)7)62-40-36(65-38-31(53)28(50)23(49)20-60-38)34(33(55)35(64-40)37(56)57)63-39-32(54)30(52)29(51)24(19-48)61-39/h8,22-36,38-40,48-55H,9-20H2,1-7H3,(H,56,57)(H,58,59)/t22-,23+,24+,25-,26+,27-,28-,29+,30-,31+,32+,33-,34-,35-,36+,38-,39-,40+,44-,45+,46+,47-/m0/s1
InChIKey DPXMETKXNWBGRI-HHAITRAOSA-N
Literature Reference Author H.F.TANG,Z.Z.WANG,Y.H.YI,Y.P.JIANG,W.J.HU,Y.Q.LI
Literature Reference Citation J.CHIN.PHARM.SCI.,6,75(1997)
Molecular Weight 927.094 g/mol
Solvent C5D5N:D2O
Source File Reference UWBT7466