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GLYPARVIN-A;(E)-3-(METHYLSULFONYL)-PROPENOIC-ACID-(E)-4-(3-(5,5-DIMETHYL-4-OXO-2-OXOLEN-2-YL)-2-BUTENYLOXY)-PHENETHYL-AMIDE
SpectraBase Compound ID GTqEI2V1Bsb
InChI InChI=1S/C22H27NO6S/c1-16(19-15-20(24)22(2,3)29-19)10-13-28-18-7-5-17(6-8-18)9-12-23-21(25)11-14-30(4,26)27/h5-8,10-11,14-15H,9,12-13H2,1-4H3,(H,23,25)/b14-11+,16-10+
InChIKey GIXCQHBTEXKBSX-VKFAFFLXSA-N
Mol Weight 433.52 g/mol
Molecular Formula C22H27NO6S
Exact Mass 433.155909 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hf92XymFDoQ
Name GLYPARVIN-A;(E)-3-(METHYLSULFONYL)-PROPENOIC-ACID-(E)-4-(3-(5,5-DIMETHYL-4-OXO-2-OXOLEN-2-YL)-2-BUTENYLOXY)-PHENETHYL-AMIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H27NO6S
InChI InChI=1S/C22H27NO6S/c1-16(19-15-20(24)22(2,3)29-19)10-13-28-18-7-5-17(6-8-18)9-12-23-21(25)11-14-30(4,26)27/h5-8,10-11,14-15H,9,12-13H2,1-4H3,(H,23,25)/b14-11+,16-10+
InChIKey GIXCQHBTEXKBSX-VKFAFFLXSA-N
Literature Reference Author O.HOFER,S.VAJRODAYA,H.GREGER
Literature Reference Citation MH.CHEM.,129,213(1998)
Literature Reference DOI 10.1007/s007060050044
Molecular Weight 433.519 g/mol
Solvent CDCl3
Source File Reference UWRU2676