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GRANDIUVARIN_A;1,6-DIBENZOYLOXY-2-ACETOXYMETHYL-2-R*,3-R*-EPOXY-HEX-4-(Z)-ENE
SpectraBase Compound ID dFABSeO7Ba
InChI InChI=1S/C23H22O7/c1-17(24)28-15-23(16-29-22(26)19-11-6-3-7-12-19)20(30-23)13-8-14-27-21(25)18-9-4-2-5-10-18/h2-13,20H,14-16H2,1H3/b13-8-/t20-,23-/m1/s1
InChIKey VLJXAFYYXGWQHV-PEHKWEQMSA-N
Mol Weight 410.42 g/mol
Molecular Formula C23H22O7
Exact Mass 410.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EUEQvKfQzYt
Name GRANDIUVARIN_A;1,6-DIBENZOYLOXY-2-ACETOXYMETHYL-2-R*,3-R*-EPOXY-HEX-4-(Z)-ENE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H22O7
InChI InChI=1S/C23H22O7/c1-17(24)28-15-23(16-29-22(26)19-11-6-3-7-12-19)20(30-23)13-8-14-27-21(25)18-9-4-2-5-10-18/h2-13,20H,14-16H2,1H3/b13-8-/t20-,23-/m1/s1
InChIKey VLJXAFYYXGWQHV-PEHKWEQMSA-N
Literature Reference Author S.ANKISETTY,H.N.ELSOHLY,X.C.LI,S.I.KHAN,B.L.TEKWANI,T.SMILLI E,L.WALKER
Literature Reference Citation J.NAT.PROD.,69,692(2006)
Literature Reference DOI 10.1021/np050500b
Molecular Weight 410.423 g/mol
Solvent CDCl3
Source File Reference UWMZ18312