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O-(2,3,4-TRI-O-ACETYL-BETA-D-XYLOPYRANOSYL)-(1->3)-(2S,3S,4E)-2-[N-(DIPHENYLMETHYLENE)-AMINO]-1-O-BENZOYL-4-TRIDECENE-1,3-DIOL
SpectraBase Compound ID HKcfbK4XEXU
InChI InChI=1S/C44H53NO10/c1-5-6-7-8-9-10-11-21-28-38(55-44-42(54-33(4)48)41(53-32(3)47)39(30-51-44)52-31(2)46)37(29-50-43(49)36-26-19-14-20-27-36)45-40(34-22-15-12-16-23-34)35-24-17-13-18-25-35/h12-28,37-39,41-42,44H,5-11,29-30H2,1-4H3/b28-21+/t37-,38-,39-,41+,42-,44+/m0/s1
InChIKey VCCVHLWLMQCPAO-ROSKKHMUSA-N
Mol Weight 755.9 g/mol
Molecular Formula C44H53NO10
Exact Mass 755.366947 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8r90gXBUEMt
Name O-(2,3,4-TRI-O-ACETYL-BETA-D-XYLOPYRANOSYL)-(1->3)-(2S,3S,4E)-2-[N-(DIPHENYLMETHYLENE)-AMINO]-1-O-BENZOYL-4-TRIDECENE-1,3-DIOL
Compound Number 11A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H53NO10
InChI InChI=1S/C44H53NO10/c1-5-6-7-8-9-10-11-21-28-38(55-44-42(54-33(4)48)41(53-32(3)47)39(30-51-44)52-31(2)46)37(29-50-43(49)36-26-19-14-20-27-36)45-40(34-22-15-12-16-23-34)35-24-17-13-18-25-35/h12-28,37-39,41-42,44H,5-11,29-30H2,1-4H3/b28-21+/t37-,38-,39-,41+,42-,44+/m0/s1
InChIKey VCCVHLWLMQCPAO-ROSKKHMUSA-N
Literature Reference Author M.A.PETERSON,R.POLT
Literature Reference Citation J.ORG.CHEM.,58,4309(1993)
Literature Reference DOI 10.1021/jo00068a028
Molecular Weight 755.906 g/mol
Solvent Unknown
Source File Reference UWSP816