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ROUREMIN;1-O-PALMITOYL-BETA-O-EICOSANOYL-3-O-(6-AMINO-6-DEOXY)-BETA-D-GLUCOPYRANOSYL-GLYCEROL
SpectraBase Compound ID 4XoK7QAbr3D
InChI InChI=1S/C45H87NO9/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-41(48)54-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)36-52-40(47)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h38-39,42-45,49-51H,3-37,46H2,1-2H3/t38?,39-,42-,43+,44-,45-/m0/s1
InChIKey ADDGQEWZHSZZRP-DZTDDVSYSA-N
Mol Weight 786.2 g/mol
Molecular Formula C45H87NO9
Exact Mass 785.638083 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7flmWRKezWg
Name ROUREMIN;1-O-PALMITOYL-BETA-O-EICOSANOYL-3-O-(6-AMINO-6-DEOXY)-BETA-D-GLUCOPYRANOSYL-GLYCEROL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H87NO9
InChI InChI=1S/C45H87NO9/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-41(48)54-38(37-53-45-44(51)43(50)42(49)39(35-46)55-45)36-52-40(47)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h38-39,42-45,49-51H,3-37,46H2,1-2H3/t38?,39-,42-,43+,44-,45-/m0/s1
InChIKey ADDGQEWZHSZZRP-DZTDDVSYSA-N
Literature Reference Author Z.D.HE,C.Y.MA,G.T.TAN,K.SYDARA,P.TAMEZ,B.SOUTHAVONG,S.BOUAMA NIVONG,D.D.SOEJARTO,
Literature Reference Citation PHYTOCHEM.,67,1378(2006)
Literature Reference DOI 10.1016/j.phytochem.2006.04.012
Molecular Weight 786.187 g/mol
Sample ID 67044
Solvent DMSO-D6