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METHYL-(1-ALPHA,4A-ALPHA,5-ALPHA,6-BETA,8A-ALPHA)-5-[2-(3-FURAN-3-ENE-2-ONE)-ETHYL]-1,2,3,4,4A,5,6,7,8,8A-DECAHYDRO-1,2-DIHYDROXY-1-NAPHTHALENECARB
SpectraBase Compound ID VNQkGCMh6s
InChI InChI=1S/C21H32O6/c1-13-7-11-20(3)15(5-6-16(22)21(20,25)18(24)26-4)19(13,2)10-8-14-9-12-27-17(14)23/h9,13,15-16,22,25H,5-8,10-12H2,1-4H3/t13-,15-,16-,19+,20+,21-/m0/s1
InChIKey WFESWMHXCOYDMS-UHORVAGXSA-N
Mol Weight 380.5 g/mol
Molecular Formula C21H32O6
Exact Mass 380.219889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dpvf8BbMX0z
Name METHYL-(1-ALPHA,4A-ALPHA,5-ALPHA,6-BETA,8A-ALPHA)-5-[2-(3-FURAN-3-ENE-2-ONE)-ETHYL]-1,2,3,4,4A,5,6,7,8,8A-DECAHYDRO-1,2-DIHYDROXY-1-NAPHTHALENECARB
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O6
InChI InChI=1S/C21H32O6/c1-13-7-11-20(3)15(5-6-16(22)21(20,25)18(24)26-4)19(13,2)10-8-14-9-12-27-17(14)23/h9,13,15-16,22,25H,5-8,10-12H2,1-4H3/t13-,15-,16-,19+,20+,21-/m0/s1
InChIKey WFESWMHXCOYDMS-UHORVAGXSA-N
Literature Reference Author C.Y.RAGASA,M.C.CRUZ,R.GULA,J.A.RIDEOUT
Literature Reference Citation J.NAT.PROD.,63,509(2000)
Literature Reference DOI 10.1021/np9902946
Molecular Weight 380.481 g/mol
Solvent CDCl3
Source File Reference UWRU5839