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12-DEACETOXY-DEOXOSCALARIN

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12-DEACETOXY-DEOXOSCALARIN
SpectraBase Compound ID 5Mraa6oVVD5
InChI InChI=1S/C25H40O2/c1-22(2)11-6-12-23(3)17(22)9-13-24(4)18-8-7-16-15-27-21(26)20(16)25(18,5)14-10-19(23)24/h7,17-21,26H,6,8-15H2,1-5H3/t17-,18-,19+,20+,21+,23-,24-,25-/m0/s1
InChIKey ZZRZTXFUKVHAHJ-JHTPQMKOSA-N
Mol Weight 372.6 g/mol
Molecular Formula C25H40O2
Exact Mass 372.302831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 639WYSl9gFv
Name 12-DEACETOXY-DEOXOSCALARIN
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H40O2
InChI InChI=1S/C25H40O2/c1-22(2)11-6-12-23(3)17(22)9-13-24(4)18-8-7-16-15-27-21(26)20(16)25(18,5)14-10-19(23)24/h7,17-21,26H,6,8-15H2,1-5H3/t17-,18-,19+,20+,21+,23-,24-,25-/m0/s1
InChIKey ZZRZTXFUKVHAHJ-JHTPQMKOSA-N
Literature Reference Author A.FONTANA,P.CAVALIERE,N.UNGUR,L.D'SOUZA,P.S.PARAMESWARAM,G.C IMINO
Literature Reference Citation J.NAT.PROD.,62,1367(1999)
Literature Reference DOI 10.1021/np9900932
Molecular Weight 372.591 g/mol
Solvent CDCl3
Source File Reference UWCS20828