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SCUPOLIN-D;(11-S)-11-ACETOXY-7-BETA-[(2'-METHYL-BUTYRYL)-OXY]-4-ALPHA,18-EPOXY-6-ALPHA,8-BETA,19-TRIHYDROXY-NEOClEROD-13-EN-15,16-OLIDEX

View entire compound with spectra: 1 NMR

SCUPOLIN-D;(11-S)-11-ACETOXY-7-BETA-[(2'-METHYL-BUTYRYL)-OXY]-4-ALPHA,18-EPOXY-6-ALPHA,8-BETA,19-TRIHYDROXY-NEOClEROD-13-EN-15,16-OLIDEX
SpectraBase Compound ID ITjiYZTk3fD
InChI InChI=1S/C27H40O10/c1-6-15(2)23(32)37-22-21(31)27(13-28)18(8-7-9-26(27)14-35-26)24(4,25(22,5)33)19(36-16(3)29)10-17-11-20(30)34-12-17/h11,15,18-19,21-22,28,31,33H,6-10,12-14H2,1-5H3/t15?,18-,19-,21+,22+,24+,25+,26+,27+/m0/s1
InChIKey CASHICPLRUEDOE-WCLGNXEGSA-N
Mol Weight 524.6 g/mol
Molecular Formula C27H40O10
Exact Mass 524.262147 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4lAvFdF2EfO
Name SCUPOLIN-D;(11-S)-11-ACETOXY-7-BETA-[(2'-METHYL-BUTYRYL)-OXY]-4-ALPHA,18-EPOXY-6-ALPHA,8-BETA,19-TRIHYDROXY-NEOClEROD-13-EN-15,16-OLIDEX
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H40O10
InChI InChI=1S/C27H40O10/c1-6-15(2)23(32)37-22-21(31)27(13-28)18(8-7-9-26(27)14-35-26)24(4,25(22,5)33)19(36-16(3)29)10-17-11-20(30)34-12-17/h11,15,18-19,21-22,28,31,33H,6-10,12-14H2,1-5H3/t15?,18-,19-,21+,22+,24+,25+,26+,27+/m0/s1
InChIKey CASHICPLRUEDOE-WCLGNXEGSA-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 524.609 g/mol
Solvent CDCl3
Source File Reference UWRU360