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REL-(2S,5R,8S,9S,10R,18S,19R)-18,19-DIACETOXY-18,19-EPOXY-2-(2-XI-METHYLBUTANOYLOXY)-CLERODA-3,13(16),14-TRIENE
SpectraBase Compound ID 8qjBkUzq9mJ
InChI InChI=1S/C29H42O7/c1-9-17(3)11-13-28(8)19(5)12-14-29-23(26(33-20(6)30)36-27(29)34-21(7)31)15-22(16-24(28)29)35-25(32)18(4)10-2/h9,15,18-19,22,24,26-27H,1,3,10-14,16H2,2,4-8H3/t18?,19?,22-,24-,26-,27+,28+,29+/m1/s1
InChIKey SELKNUHSHRDLFR-ORXBVNENSA-N
Mol Weight 502.6 g/mol
Molecular Formula C29H42O7
Exact Mass 502.293054 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7TFxdVSzJQ4
Name REL-(2S,5R,8S,9S,10R,18S,19R)-18,19-DIACETOXY-18,19-EPOXY-2-(2-XI-METHYLBUTANOYLOXY)-CLERODA-3,13(16),14-TRIENE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H42O7
InChI InChI=1S/C29H42O7/c1-9-17(3)11-13-28(8)19(5)12-14-29-23(26(33-20(6)30)36-27(29)34-21(7)31)15-22(16-24(28)29)35-25(32)18(4)10-2/h9,15,18-19,22,24,26-27H,1,3,10-14,16H2,2,4-8H3/t18?,19?,22-,24-,26-,27+,28+,29+/m1/s1
InChIKey SELKNUHSHRDLFR-ORXBVNENSA-N
Literature Reference Author C.V.S.PRAKASH,J.M.HOCH,D.G.I.KINGSTON
Literature Reference Citation J.NAT.PROD.,65,100(2002)
Literature Reference DOI 10.1021/np010405c
Molecular Weight 502.648 g/mol
Solvent CDCl3
Source File Reference UWSI2706