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N-DOCOSANOYL-D-ERYTHRO-(2S,3R)-16-METHYL-HEPTADECASPHING-(4E)-ENINE;C-22-CERAMIDE

View entire compound with spectra: 1 NMR

N-DOCOSANOYL-D-ERYTHRO-(2S,3R)-16-METHYL-HEPTADECASPHING-(4E)-ENINE;C-22-CERAMIDE
SpectraBase Compound ID 1Tqj13N5Pgg
InChI InChI=1S/C40H79NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-26-29-32-35-40(44)41-38(36-42)39(43)34-31-28-25-22-20-19-21-24-27-30-33-37(2)3/h31,34,37-39,42-43H,4-30,32-33,35-36H2,1-3H3,(H,41,44)/b34-31+/t38-,39-/m1/s1
InChIKey QIMUKWDDYXPHJV-VAUJITIYSA-N
Mol Weight 622.1 g/mol
Molecular Formula C40H79NO3
Exact Mass 621.605995 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KxlwgpZvbW4
Name N-DOCOSANOYL-D-ERYTHRO-(2S,3R)-16-METHYL-HEPTADECASPHING-(4E)-ENINE;C-22-CERAMIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H79NO3
InChI InChI=1S/C40H79NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-26-29-32-35-40(44)41-38(36-42)39(43)34-31-28-25-22-20-19-21-24-27-30-33-37(2)3/h31,34,37-39,42-43H,4-30,32-33,35-36H2,1-3H3,(H,41,44)/b34-31+/t38-,39-/m1/s1
InChIKey QIMUKWDDYXPHJV-VAUJITIYSA-N
Literature Reference Author X.ZHOU,X.LIN,X.GUO,B.YANG,X.W.YANG,Y.LIU
Literature Reference Citation REC.NAT.PROD.,7,119(2013)
Molecular Weight 622.072 g/mol
Solvent CDCl3
Source File Reference UWLU80843