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VERNOLIDE-C;8-ALPHA-(3-CHLORO-2-HYDROXY-2-METHYLPROPANOYLOXY)-HIRSUTINOLIDE-13-O-ACETATE
SpectraBase Compound ID CCWFNKGdas6
InChI InChI=1S/C21H27ClO9/c1-11-7-14(30-18(25)20(4,26)10-22)16-13(9-28-12(2)23)17(24)29-15(16)8-19(3)5-6-21(11,27)31-19/h8,11,14,26-27H,5-7,9-10H2,1-4H3/b15-8+/t11-,14+,19-,20?,21-/m1/s1
InChIKey KBNAVWJVMFKJOU-WFLFDFGMSA-N
Mol Weight 458.89 g/mol
Molecular Formula C21H27ClO9
Exact Mass 458.13436 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HANJ6xmgND2
Name VERNOLIDE-C;8-ALPHA-(3-CHLORO-2-HYDROXY-2-METHYLPROPANOYLOXY)-HIRSUTINOLIDE-13-O-ACETATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H27ClO9
InChI InChI=1S/C21H27ClO9/c1-11-7-14(30-18(25)20(4,26)10-22)16-13(9-28-12(2)23)17(24)29-15(16)8-19(3)5-6-21(11,27)31-19/h8,11,14,26-27H,5-7,9-10H2,1-4H3/b15-8+/t11-,14+,19-,20?,21-/m1/s1
InChIKey KBNAVWJVMFKJOU-WFLFDFGMSA-N
Literature Reference Author A.CHEA,S.HOUT,C.LONG,L.MARCOURT,R.FAURE,N.AZAS,R.ELIAS
Literature Reference Citation CHEM.PHARM.BULL.,54,1437(2006)
Literature Reference DOI 10.1248/cpb.54.1437
Molecular Weight 458.893 g/mol
Sample ID 55271
Solvent CDCl3