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SCUPOLIN-H;(11-S,13-S,16-S,19-S)-6-ALPHA-ACETOXY-2-ALPHA,19;4-ALPHA,18;11,16;15,16-TETRAEPOXY-19-METHOXY-NEOClEROD-14-ENE

View entire compound with spectra: 1 NMR

SCUPOLIN-H;(11-S,13-S,16-S,19-S)-6-ALPHA-ACETOXY-2-ALPHA,19;4-ALPHA,18;11,16;15,16-TETRAEPOXY-19-METHOXY-NEOClEROD-14-ENE
SpectraBase Compound ID 8Fmn4DBKqhy
InChI InChI=1S/C23H32O7/c1-12-7-18(28-13(2)24)23-16(9-15(29-20(23)25-4)10-22(23)11-27-22)21(12,3)17-8-14-5-6-26-19(14)30-17/h5-6,12,14-20H,7-11H2,1-4H3/t12-,14+,15-,16?,17-,18+,19-,20+,21+,22+,23+/m1/s1
InChIKey CYPQMJCIYPVOPW-GLSOZFMBSA-N
Mol Weight 420.5 g/mol
Molecular Formula C23H32O7
Exact Mass 420.214803 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IM80pkEqPhT
Name SCUPOLIN-H;(11-S,13-S,16-S,19-S)-6-ALPHA-ACETOXY-2-ALPHA,19;4-ALPHA,18;11,16;15,16-TETRAEPOXY-19-METHOXY-NEOClEROD-14-ENE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H32O7
InChI InChI=1S/C23H32O7/c1-12-7-18(28-13(2)24)23-16(9-15(29-20(23)25-4)10-22(23)11-27-22)21(12,3)17-8-14-5-6-26-19(14)30-17/h5-6,12,14-20H,7-11H2,1-4H3/t12-,14+,15-,16?,17-,18+,19-,20+,21+,22+,23+/m1/s1
InChIKey CYPQMJCIYPVOPW-GLSOZFMBSA-N
Literature Reference Author M.C.DELATORRE,B.RODRIGUEZ,M.BRUNO,N.VASSALO,M.L.BONDI,F.PIOZ ZI,O.SERVETTAZ
Literature Reference Citation J.NAT.PROD.,60,1229(1997)
Literature Reference DOI 10.1021/np970213a
Molecular Weight 420.503 g/mol
Solvent CDCl3
Source File Reference UWRU364