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Carbonolide B Methoxy Acetal

View entire compound with spectra: 1 MS (GC)

Carbonolide B Methoxy Acetal
SpectraBase Compound ID 6Ofj1IHmL84
InChI InChI=1S/C23H34O8/c1-14-11-17-12-21(27-4)31-22(17)23(28-5)19(30-16(3)24)13-20(26)29-15(2)9-7-6-8-10-18(14)25/h6-8,10,14-15,17,19,21-23H,9,11-13H2,1-5H3/b7-6+,10-8+/t14-,15-,17-,19-,21?,22+,23+/m1/s1
InChIKey LVLLQCGGWDQVBI-MZXYCPPNSA-N
Mol Weight 438.5 g/mol
Molecular Formula C23H34O8
Exact Mass 438.225368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GcRQ62mNSJw
Name Carbonolide B Methoxy Acetal
Alternate Name(s) (3aR,5R,12R,16R,17S,17aS)-2,17-dimethoxy-5,12-dimethyl-6,14-dioxo-2,3,3a,5,6,11,12,14,15,16,17,17a-dodecahydro-4H-furo[2,3-f]oxacyclohexadecin-16-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O8
InChI InChI=1S/C23H34O8/c1-14-11-17-12-21(27-4)31-22(17)23(28-5)19(30-16(3)24)13-20(26)29-15(2)9-7-6-8-10-18(14)25/h6-8,10,14-15,17,19,21-23H,9,11-13H2,1-5H3/b7-6+,10-8+/t14-,15-,17-,19-,21?,22+,23+/m1/s1
InChIKey LVLLQCGGWDQVBI-MZXYCPPNSA-N
Molecular Weight 438.517 g/mol
SMILES [C@@]12([C@]([C@@](CC(O[C@@](C\C=C\C=C\C([C@@](C[C@@]2(CC(O1)OC)[H])(C)[H])=O)(C)[H])=O)(OC(=O)C)[H])(OC)[H])[H]
SPLASH splash10-004s-8900200000-04cb2586069075990b2f
Source of Spectrum J-59-3122-48
Wiley ID 533782