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OCIMUMOSIDE_A;(2-S)-1-O-HEXADECANOYL-(2-O-DOCOSANOYL)-3-O-[6-DEOXY-6-AMINO-ALPHA-D-GLUCOPYRANOSIDE]-GLYCEROL
SpectraBase Compound ID CMMJjSQobO2
InChI InChI=1S/C47H91NO9/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-43(50)56-40(39-55-47-46(53)45(52)44(51)41(37-48)57-47)38-54-42(49)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h40-41,44-47,51-53H,3-39,48H2,1-2H3/t40-,41-,44-,45+,46-,47+/m1/s1
InChIKey BZZSCXPOEAFLES-NUTCYAROSA-N
Mol Weight 814.2 g/mol
Molecular Formula C47H91NO9
Exact Mass 813.669384 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jq2IeC4jhdB
Name OCIMUMOSIDE_A;(2-S)-1-O-HEXADECANOYL-(2-O-DOCOSANOYL)-3-O-[6-DEOXY-6-AMINO-ALPHA-D-GLUCOPYRANOSIDE]-GLYCEROL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C47H91NO9
InChI InChI=1S/C47H91NO9/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-43(50)56-40(39-55-47-46(53)45(52)44(51)41(37-48)57-47)38-54-42(49)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h40-41,44-47,51-53H,3-39,48H2,1-2H3/t40-,41-,44-,45+,46-,47+/m1/s1
InChIKey BZZSCXPOEAFLES-NUTCYAROSA-N
Literature Reference Author P.GUPTA,D.K.YADAV,K.B.SIRIPURAPU,G.PALIT,R.MAURYA
Literature Reference Citation J.NAT.PROD.,70,1410(2007)
Literature Reference DOI 10.1021/np0700164
Molecular Weight 814.241 g/mol
Sample ID 31501
Solvent DMSO-D6