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12-ALPHA-(3'-ACETOXYBUTANOYLOXY)-20,24-DIMETHYL-24-OXOSCALAR-16-EN-25-AL
SpectraBase Compound ID Gp1DN7Yr4x2
InChI InChI=1S/C33H50O6/c1-9-30(5)14-10-15-31(6)25(30)13-16-32(7)26-12-11-23(21(3)35)24(19-34)33(26,8)28(18-27(31)32)39-29(37)17-20(2)38-22(4)36/h11,19-20,24-28H,9-10,12-18H2,1-8H3/t20?,24-,25-,26-,27+,28-,30-,31-,32-,33+/m0/s1
InChIKey FLDWVIJFICOBAR-UHIUMASJSA-N
Mol Weight 542.8 g/mol
Molecular Formula C33H50O6
Exact Mass 542.360739 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DIKpVnUBb6a
Name 12-ALPHA-(3'-ACETOXYBUTANOYLOXY)-20,24-DIMETHYL-24-OXOSCALAR-16-EN-25-AL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H50O6
InChI InChI=1S/C33H50O6/c1-9-30(5)14-10-15-31(6)25(30)13-16-32(7)26-12-11-23(21(3)35)24(19-34)33(26,8)28(18-27(31)32)39-29(37)17-20(2)38-22(4)36/h11,19-20,24-28H,9-10,12-18H2,1-8H3/t20?,24-,25-,26-,27+,28-,30-,31-,32-,33+/m0/s1
InChIKey FLDWVIJFICOBAR-UHIUMASJSA-N
Literature Reference Author B.F.BOWDEN,J.C.COLL,H.LI,R.C.CAMBIE,M.R.KERNAN,P.R.BERGQUIST
Literature Reference Citation J.NAT.PROD.,55,1234(1992)
Literature Reference DOI 10.1021/np50087a009
Molecular Weight 542.756 g/mol
Solvent CDCl3
Source File Reference UWTS557