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(3Z,5E)-8-O-ACETYL-7-O-BENZYL-3-CHLOROMETHYL-1,3,4,5,6-PENTADEOXY-D-GLYCERO-OCTERT-3,5-DIENE-2-ULOSE
SpectraBase Compound ID IXpbocFNiy4
InChI InChI=1S/C18H21ClO4/c1-14(20)17(11-19)9-6-10-18(13-22-15(2)21)23-12-16-7-4-3-5-8-16/h3-10,18H,11-13H2,1-2H3/b10-6+,17-9+/t18-/m0/s1
InChIKey GXACBUXJASTCGJ-IOWDTFEGSA-N
Mol Weight 336.82 g/mol
Molecular Formula C18H21ClO4
Exact Mass 336.112837 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5zF6gq06vU5
Name (3Z,5E)-8-O-ACETYL-7-O-BENZYL-3-CHLOROMETHYL-1,3,4,5,6-PENTADEOXY-D-GLYCERO-OCTERT-3,5-DIENE-2-ULOSE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H21ClO4
InChI InChI=1S/C18H21ClO4/c1-14(20)17(11-19)9-6-10-18(13-22-15(2)21)23-12-16-7-4-3-5-8-16/h3-10,18H,11-13H2,1-2H3/b10-6+,17-9+/t18-/m0/s1
InChIKey GXACBUXJASTCGJ-IOWDTFEGSA-N
Literature Reference Author R.PATHAK,C.S.PANT,A.K.SHAW,A.P.BHADURI,A.N.GAIKWAD,S.SINHA,A .SRIVASTAVA,K.K.SRIV
Literature Reference Citation BIOORG.MED.CHEM.,10,3187(2002)
Literature Reference DOI 10.1016/S0968-0896(02)00210-9
Molecular Weight 336.815 g/mol
Solvent CDCl3
Source File Reference UWSI24293