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UJPRDCNDXGXVAD-TYCMWQKZSA-N
SpectraBase Compound ID 11H9l6PTRdX
InChI InChI=1S/C31H48O6/c1-9-28(5)12-10-13-29(6)23(28)11-14-30(7)24(29)16-26(37-20(4)35)31(8)21(17-32)27(18(2)33)22(15-25(30)31)36-19(3)34/h17,21-27H,9-16H2,1-8H3/t21-,22-,23-,24+,25-,26-,27-,28-,29-,30+,31+/m0/s1
InChIKey UJPRDCNDXGXVAD-TYCMWQKZSA-N
Mol Weight 516.7 g/mol
Molecular Formula C31H48O6
Exact Mass 516.345089 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8egAdChmfzD
Name 12-ALPHA,16-BETA-DIACETOXY-20,24-DIMETHYL-24-OXOSCALARAN-25-AL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H48O6
InChI InChI=1S/C31H48O6/c1-9-28(5)12-10-13-29(6)23(28)11-14-30(7)24(29)16-26(37-20(4)35)31(8)21(17-32)27(18(2)33)22(15-25(30)31)36-19(3)34/h17,21-27H,9-16H2,1-8H3/t21-,22-,23-,24+,25-,26-,27-,28-,29-,30+,31+/m0/s1
InChIKey UJPRDCNDXGXVAD-TYCMWQKZSA-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 516.719 g/mol
Solvent CDCl3
Source File Reference UWTS553