John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=HmPlIN12nH8 SpectraBase Spectrum ID=10bzwpP3b5l

(accessed ).
3-BETA,6-BETA,7-BETA-TRIHYDROXY-20(29)-LUPENE
SpectraBase Compound ID HmPlIN12nH8
InChI InChI=1S/C30H50O3/c1-17(2)18-11-13-27(5)15-16-29(7)19(22(18)27)9-10-20-28(6)14-12-21(31)26(3,4)24(28)23(32)25(33)30(20,29)8/h18-25,31-33H,1,9-16H2,2-8H3/t18-,19?,20?,21-,22?,23-,24?,25-,27+,28+,29+,30-/m0/s1
InChIKey OCIKTLKJZUGMBU-SJYWGTFUSA-N
Mol Weight 458.7 g/mol
Molecular Formula C30H50O3
Exact Mass 458.375996 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10bzwpP3b5l
Name 3-BETA,6-BETA,7-BETA-TRIHYDROXY-20(29)-LUPENE
Compound Number 1
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H50O3
InChI InChI=1S/C30H50O3/c1-17(2)18-11-13-27(5)15-16-29(7)19(22(18)27)9-10-20-28(6)14-12-21(31)26(3,4)24(28)23(32)25(33)30(20,29)8/h18-25,31-33H,1,9-16H2,2-8H3/t18-,19?,20?,21-,22?,23-,24?,25-,27+,28+,29+,30-/m0/s1
InChIKey OCIKTLKJZUGMBU-SJYWGTFUSA-N
Literature Reference Author Z.H.JIANG,T.TANAKA,I.KOUNO
Literature Reference Citation PHYTOCHEM.,40,1223(1995)
Literature Reference DOI 10.1016/0031-9422(95)00412-Z
Molecular Weight 458.725 g/mol
Solvent C5D5N
Source File Reference UWMS2814
SpectraBase Batch ID JOycpdEDmEE