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2-ALPHA-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSYL-3-O-OLEANOLIC-ACID
SpectraBase Compound ID 24FBKwTM3u7
InChI InChI=1S/C42H68O13/c1-37(2)14-16-42(36(50)51)17-15-40(6)21(22(42)18-37)8-9-26-39(5)12-11-27(38(3,4)25(39)10-13-41(26,40)7)54-35-33(31(48)29(46)24(20-44)53-35)55-34-32(49)30(47)28(45)23(19-43)52-34/h8,22-35,43-49H,9-20H2,1-7H3,(H,50,51)/t22-,23?,24?,25-,26+,27-,28?,29?,30?,31?,32?,33?,34?,35?,39-,40+,41+,42-/m0/s1
InChIKey LEQCLUFJRGKLOA-JLRAIIHGSA-N
Mol Weight 781.0 g/mol
Molecular Formula C42H68O13
Exact Mass 780.465992 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID La17ra2aJTT
Name 2-BETA-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSYL-3-O-OLEANOLIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H68O13
InChI InChI=1S/C42H68O13/c1-37(2)14-16-42(36(50)51)17-15-40(6)21(22(42)18-37)8-9-26-39(5)12-11-27(38(3,4)25(39)10-13-41(26,40)7)54-35-33(31(48)29(46)24(20-44)53-35)55-34-32(49)30(47)28(45)23(19-43)52-34/h8,22-35,43-49H,9-20H2,1-7H3,(H,50,51)/t22-,23?,24?,25-,26+,27-,28?,29?,30?,31?,32?,33?,34?,35?,39-,40+,41+,42-/m0/s1
InChIKey LEQCLUFJRGKLOA-JLRAIIHGSA-N
Literature Reference Author W.SEEBACHER,R.WEIS,J.JURENITSCH,K.RAUCHENSTEINER,E.HASLINGER
Literature Reference Citation MH.CHEM.,131,985(2000)
Literature Reference DOI 10.1007/s007060070055
Molecular Weight 780.994 g/mol
Solvent CD3OD
Source File Reference UWRU1379