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BARRINGTOGENOL-C;3-BETA,16-ALPHA,21-BETA,22-ALPHA,28-PENTAHYDROXY-DELTA(12)-OLEANANE
SpectraBase Compound ID HkMN01WIyBF
InChI InChI=1S/C30H50O5/c1-25(2)14-18-17-8-9-20-27(5)12-11-21(32)26(3,4)19(27)10-13-28(20,6)29(17,7)15-22(33)30(18,16-31)24(35)23(25)34/h8,18-24,31-35H,9-16H2,1-7H3/t18-,19-,20+,21-,22+,23-,24-,27-,28+,29+,30-/m0/s1
InChIKey AYDKOFQQBHRXEW-AAUPIIFFSA-N
Mol Weight 490.7 g/mol
Molecular Formula C30H50O5
Exact Mass 490.365825 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8lrgp9nhklF
Name BARRINGTOGENOL-C;3-BETA,16-ALPHA,21-BETA,22-ALPHA,28-PENTAHYDROXY-DELTA(12)-OLEANANE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H50O5
InChI InChI=1S/C30H50O5/c1-25(2)14-18-17-8-9-20-27(5)12-11-21(32)26(3,4)19(27)10-13-28(20,6)29(17,7)15-22(33)30(18,16-31)24(35)23(25)34/h8,18-24,31-35H,9-16H2,1-7H3/t18-,19-,20+,21-,22+,23-,24-,27-,28+,29+,30-/m0/s1
InChIKey AYDKOFQQBHRXEW-AAUPIIFFSA-N
Literature Reference Author M.D.GRECA,A.FIORENTINO,P.MONACO,L.PREVITERA
Literature Reference Citation PHYTOCHEM.,35,201(1994)
Literature Reference DOI 10.1016/s0031-9422(00)90534-x
Molecular Weight 490.724 g/mol
Solvent C5D5N
Source File Reference UWLU24145