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ASITRILOBIN-D

View entire compound with spectra: 1 NMR

ASITRILOBIN-D
SpectraBase Compound ID Jf0DIrP0lk4
InChI InChI=1S/C37H68O7/c1-3-4-5-6-7-8-12-19-24-33(40)35-25-26-36(44-35)34(41)28-32(39)23-18-14-13-17-22-31(38)21-16-11-9-10-15-20-30-27-29(2)43-37(30)42/h27,29,31-36,38-41H,3-26,28H2,1-2H3/t29-,31+,32-,33+,34+,35+,36+/m0/s1
InChIKey IFULYTAZAAQCHW-UXXGTDFTSA-N
Mol Weight 624.9 g/mol
Molecular Formula C37H68O7
Exact Mass 624.496505 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gmhue8FVFdE
Name ASITRILOBIN-D
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H68O7
InChI InChI=1S/C37H68O7/c1-3-4-5-6-7-8-12-19-24-33(40)35-25-26-36(44-35)34(41)28-32(39)23-18-14-13-17-22-31(38)21-16-11-9-10-15-20-30-27-29(2)43-37(30)42/h27,29,31-36,38-41H,3-26,28H2,1-2H3/t29-,31+,32-,33+,34+,35+,36+/m0/s1
InChIKey IFULYTAZAAQCHW-UXXGTDFTSA-N
Literature Reference Author M.H.WOO,S.O.CHUNG,D.H.KIM
Literature Reference Citation BIOORG.MED.CHEM.,8,285(2000)
Literature Reference DOI 10.1016/S0968-0896(99)00277-1
Molecular Weight 624.943 g/mol
Solvent CDCl3
Source File Reference UWVN20092