John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=FhKPHwSKyTu SpectraBase Spectrum ID=1Kg7bKwq2VT

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3-O-BETA-[RHAMNOPYRANOSYL-(1->2)-GALACTURONOPYRANOSYL-(1->3)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID
SpectraBase Compound ID FhKPHwSKyTu
InChI InChI=1S/C48H74O19/c1-20-26(49)27(50)30(53)39(62-20)67-36-29(52)28(51)34(37(56)57)66-41(36)64-33-31(54)35(38(58)59)65-40(32(33)55)63-25-12-13-45(6)23(44(25,4)5)11-14-47(8)24(45)10-9-21-22-19-43(2,3)15-17-48(22,42(60)61)18-16-46(21,47)7/h9,20,22-36,39-41,49-55H,10-19H2,1-8H3,(H,56,57)(H,58,59)(H,60,61)/t20-,22?,23?,24?,25-,26-,27+,28+,29-,30+,31-,32+,33-,34-,35-,36+,39-,40+,41+,45-,46+,47+,48-/m0/s1
InChIKey NRAKJDPRAQFBBD-UKTAJDCJSA-N
Mol Weight 955.1 g/mol
Molecular Formula C48H74O19
Exact Mass 954.482431 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Kg7bKwq2VT
Name 3-O-BETA-[RHAMNOPYRANOSYL-(1->2)-GALACTURONOPYRANOSYL-(1->3)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H74O19
InChI InChI=1S/C48H74O19/c1-20-26(49)27(50)30(53)39(62-20)67-36-29(52)28(51)34(37(56)57)66-41(36)64-33-31(54)35(38(58)59)65-40(32(33)55)63-25-12-13-45(6)23(44(25,4)5)11-14-47(8)24(45)10-9-21-22-19-43(2,3)15-17-48(22,42(60)61)18-16-46(21,47)7/h9,20,22-36,39-41,49-55H,10-19H2,1-8H3,(H,56,57)(H,58,59)(H,60,61)/t20-,22?,23?,24?,25-,26-,27+,28+,29-,30+,31-,32+,33-,34-,35-,36+,39-,40+,41+,45-,46+,47+,48-/m0/s1
InChIKey NRAKJDPRAQFBBD-UKTAJDCJSA-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 955.104 g/mol
Solvent C5D5N
Source File Reference UWVN1199
SpectraBase Batch ID GUbAztbC34s