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8-HYDROXYISOCAPNOLACTONE-2',3'-DIOL;(2'R,3'S,2''S)-8-HYDROXY-7-[4'-(4''-METHYLENE-5''-OXO-2''-TETRAHYDROFURANYL)-3'-METHYL-2',3'-DIHYDROXYBUTOXY]COUMAR
SpectraBase Compound ID CCHbUbjZLSB
InChI InChI=1S/C19H20O8/c1-10-7-12(26-18(10)23)8-19(2,24)14(20)9-25-13-5-3-11-4-6-15(21)27-17(11)16(13)22/h3-6,12,14,20,22,24H,1,7-9H2,2H3/t12-,14+,19?/m0/s1
InChIKey TUZIOBDADOLYSB-OSHZWXCDSA-N
Mol Weight 376.36 g/mol
Molecular Formula C19H20O8
Exact Mass 376.115818 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Did4Dm4joE9
Name 8-HYDROXYISOCAPNOLACTONE-2',3'-DIOL;(2'R,3'S,2''S)-8-HYDROXY-7-[4'-(4''-METHYLENE-5''-OXO-2''-TETRAHYDROFURANYL)-3'-METHYL-2',3'-DIHYDROXYBUTOXY]COUMAR
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H20O8
InChI InChI=1S/C19H20O8/c1-10-7-12(26-18(10)23)8-19(2,24)14(20)9-25-13-5-3-11-4-6-15(21)27-17(11)16(13)22/h3-6,12,14,20,22,24H,1,7-9H2,2H3/t12-,14+,19?/m0/s1
InChIKey TUZIOBDADOLYSB-OSHZWXCDSA-N
Literature Reference Author M.RAHMANI,R.A.SUSIDARTI,H.B.M.ISMAIL,M.A.SUKARI,T.Y.Y.HIN,G. E.C.LIAN,A.M.ALI,J.K
Literature Reference Citation PHYTOCHEM.,64,873(2003)
Literature Reference DOI 10.1016/j.phytochem.2003.08.007
Molecular Weight 376.363 g/mol
Solvent CDCl3
Source File Reference UWKP5824