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(2'S,4'S,5'S)-5,6-DIMETHOXY-4-HYDROXY-5'-CHLORO-2',4'-DIMETHYL-1'-OXOHEPTYL-2-HYDROXYPYRIDINE;ATPENIN-A4
SpectraBase Compound ID 7ImPi8GhwOF
InChI InChI=1S/C15H22ClNO5/c1-7(9(3)16)6-8(2)11(18)10-12(19)13(21-4)15(22-5)17-14(10)20/h7-9H,6H2,1-5H3,(H2,17,19,20)/t7-,8-,9-/m0/s1
InChIKey LDPADGWFJFHTLH-CIUDSAMLSA-N
Mol Weight 331.8 g/mol
Molecular Formula C15H22ClNO5
Exact Mass 331.118651 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3qCbStP9Vtn
Name (2'S,4'S,5'S)-5,6-DIMETHOXY-4-HYDROXY-5'-CHLORO-2',4'-DIMETHYL-1'-OXOHEPTYL-2-HYDROXYPYRIDINE;ATPENIN-A4
Compound Number I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H22ClNO5
InChI InChI=1S/C15H22ClNO5/c1-7(9(3)16)6-8(2)11(18)10-12(19)13(21-4)15(22-5)17-14(10)20/h7-9H,6H2,1-5H3,(H2,17,19,20)/t7-,8-,9-/m0/s1
InChIKey LDPADGWFJFHTLH-CIUDSAMLSA-N
Literature Reference Author H.KUMAGAI,H.NISHIDA,N.IMAMURA,H.TOMODA,S.OMURA,J.BORDNER
Literature Reference Citation J.ANTIBIOTICS,43,1553(1990)
Literature Reference DOI 10.7164/antibiotics.43.1553
Molecular Weight 331.796 g/mol
Sample ID 66445
Solvent CDCl3