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(7S,8R,8'R,4''S,5'',S7''S,10''S)-9-O-(11-HYDROXY-EUDESMAN-4-YL)-DIHYDRO-SESAMIN
SpectraBase Compound ID 9O9y1qJpFpJ
InChI InChI=1S/C35H46O7/c1-33(2,36)25-10-13-34(3)11-5-12-35(4,31(34)17-25)42-19-26-24(14-22-6-8-27-29(15-22)40-20-38-27)18-37-32(26)23-7-9-28-30(16-23)41-21-39-28/h6-9,15-16,24-26,31-32,36H,5,10-14,17-21H2,1-4H3/t24-,25-,26-,31-,32+,34-,35-/m0/s1
InChIKey MCNBQWJKHHPKBD-ONPJRHEZSA-N
Mol Weight 578.7 g/mol
Molecular Formula C35H46O7
Exact Mass 578.324354 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IbpbFNYcray
Name (7S,8R,8'R,4''S,5'',S7''S,10''S)-9-O-(11-HYDROXY-EUDESMAN-4-YL)-DIHYDRO-SESAMIN
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H46O7
InChI InChI=1S/C35H46O7/c1-33(2,36)25-10-13-34(3)11-5-12-35(4,31(34)17-25)42-19-26-24(14-22-6-8-27-29(15-22)40-20-38-27)18-37-32(26)23-7-9-28-30(16-23)41-21-39-28/h6-9,15-16,24-26,31-32,36H,5,10-14,17-21H2,1-4H3/t24-,25-,26-,31-,32+,34-,35-/m0/s1
InChIKey MCNBQWJKHHPKBD-ONPJRHEZSA-N
Literature Reference Author M.KUROYANAGI,R.IKEDA,H.Y.GAO,N.MUTO,K.OTAKI,T.SANO,N.KAWAHAR A,T.NAKANE
Literature Reference Citation CHEM.PHARM.BULL.,56,60(2008)
Literature Reference DOI 10.1248/cpb.56.60
Molecular Weight 578.746 g/mol
Sample ID 1210
Solvent CDCl3