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Aplyolide B

View entire compound with spectra: 2 NMR, and 1 MS (GC)

Aplyolide B
SpectraBase Compound ID 4D5LsIhmDJV
InChI InChI=1S/C18H30O3/c1-2-17-16(19)14-12-10-8-6-4-3-5-7-9-11-13-15-18(20)21-17/h4,6,10,12,16-17,19H,2-3,5,7-9,11,13-15H2,1H3/b6-4-,12-10-/t16-,17-/m0/s1
InChIKey FYQCXLILPFHHCJ-RKMSSTJHSA-N
Mol Weight 294.44 g/mol
Molecular Formula C18H30O3
Exact Mass 294.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfcTPdW0q5q
Name Aplyolide B
Alternate Name(s) (10Z,13Z)-(16S,17S)-17-Ethyl-16-hydroxy-oxacycloheptadeca-10,13-dien-2-one (10Z,13Z,16S,17S)-17-ethyl-16-oxidanyl-1-oxacycloheptadeca-10,13-dien-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30O3
InChI InChI=1S/C18H30O3/c1-2-17-16(19)14-12-10-8-6-4-3-5-7-9-11-13-15-18(20)21-17/h4,6,10,12,16-17,19H,2-3,5,7-9,11,13-15H2,1H3/b6-4-,12-10-/t16-,17-/m0/s1
InChIKey FYQCXLILPFHHCJ-RKMSSTJHSA-N
Molecular Weight 294.435 g/mol
SMILES O[C@@]1([C@@](OC(=O)CCCCCCC\C=C/C\C=C/C1)(CC)[H])[H]
SPLASH splash10-004l-9320000000-04d55731fc12887d0b49
Source of Spectrum J-62-5475-3
Wiley ID 1297503