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Betulonic acid
SpectraBase Compound ID BMYTQVVJqr4
InChI InChI=1S/C30H46O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-22,24H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,24+,27?,28?,29?,30-/m0/s1
InChIKey SLJTWDNVZKIDAU-ZRHKBROASA-N
Mol Weight 454.7 g/mol
Molecular Formula C30H46O3
Exact Mass 454.344695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C590ChdWBCR
Name BETULONIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46O3
InChI InChI=1S/C30H46O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-22,24H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,24+,27?,28?,29?,30-/m0/s1
InChIKey SLJTWDNVZKIDAU-ZRHKBROASA-N
Literature Reference Author N.MELNIKOVA,I.BURLOVA,T.KISELEVA,I.KLABUKOVA,M.GULENOVA,A.KI SLITSIN,V.VASIN,B.TA
Literature Reference Citation MOLECULES,17,11849(2012)
Literature Reference DOI 10.3390/molecules171011849
Molecular Weight 454.693 g/mol
Sample ID 1424
Solvent DMSO-D6