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6,7-DIHYDROXY-7-(3-HYDROXYMETHYLOXIRANYL)-2-PROPENYLHEPT-2,4-DIENOL;ISOMER_A
SpectraBase Compound ID Fb3QwQkpF1t
InChI InChI=1S/C13H18O5/c1-2-4-9(7-14)5-3-6-10(16)12(17)13-11(8-15)18-13/h2-7,10-13,15-17H,8H2,1H3/b4-2+,6-3+,9-5-
InChIKey VAEGPTFYQCVMTP-HUJNKONTSA-N
Mol Weight 254.28 g/mol
Molecular Formula C13H18O5
Exact Mass 254.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K7XDAIgr8uP
Name 6,7-DIHYDROXY-7-(3-HYDROXYMETHYLOXIRANYL)-2-PROPENYLHEPT-2,4-DIENOL;ISOMER_B
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O5
InChI InChI=1S/C13H18O5/c1-2-4-9(7-14)5-3-6-10(16)12(17)13-11(8-15)18-13/h2-7,10-13,15-17H,8H2,1H3/b4-2+,6-3+,9-5-
InChIKey VAEGPTFYQCVMTP-HUJNKONTSA-N
Literature Reference Author M.CHINWORRUNGSEE,P.KITTAKOOP,J.SAENBOONRUENG,P.KONGSAEREE,Y. THEBTARANONTH
Literature Reference Citation J.NAT.PROD.,69,1404(2006)
Literature Reference DOI 10.1021/np0601197
Molecular Weight 254.283 g/mol
Solvent CD3OD
Source File Reference UWMZ15761