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Briareolide J
SpectraBase Compound ID A1vYNSUzdq1
InChI InChI=1S/C26H36O7/c1-7-8-21(28)33-20-11-9-14(2)13-18-22(16(4)25(30)32-18)24(29)23-15(3)10-12-19(26(20,23)6)31-17(5)27/h10,13,18-20,23-24,29H,7-9,11-12H2,1-6H3/b14-13-/t18-,19-,20-,23+,24+,26+/m0/s1
InChIKey RXAUMCHNFMHTIK-OACUOQAKSA-N
Mol Weight 460.6 g/mol
Molecular Formula C26H36O7
Exact Mass 460.246103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6LabGfzFnmM
Name Briareolide J
Alternate Name(s) (3aS,8S,8aS,9S,12aS,13S)-9-(acetyloxy)-13-hydroxy-1,5,8a,12-tetramethyl-2-oxo-2,3a,6,7,8,8a,9,10,12a,13-decahydrobenzo[4,5]cyclodeca[1,2-b]furan-8-yl butyrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36O7
InChI InChI=1S/C26H36O7/c1-7-8-21(28)33-20-11-9-14(2)13-18-22(16(4)25(30)32-18)24(29)23-15(3)10-12-19(26(20,23)6)31-17(5)27/h10,13,18-20,23-24,29H,7-9,11-12H2,1-6H3/b14-13-/t18-,19-,20-,23+,24+,26+/m0/s1
InChIKey RXAUMCHNFMHTIK-OACUOQAKSA-N
Molecular Weight 460.567 g/mol
SMILES O[C@]1([C@@]2([C@]([C@@](OC(=O)C)(CC=C2C)[H])([C@@](OC(=O)CCC)(CC\C(=C/[C@]2(C1=C(C(=O)O2)C)[H])C)[H])C)[H])[H]
SPLASH splash10-00di-3791000000-9a16ffec1d5ad4288573
Source of Spectrum F-52-9961-10
Wiley ID 797853