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Denticulatin B
SpectraBase Compound ID C5M5DtNZUI8
InChI InChI=1S/C23H40O5/c1-9-11-13(3)12-14(4)20(25)17(7)23(27)18(8)21(26)16(6)22(28-23)15(5)19(24)10-2/h11,14-18,21-22,26-27H,9-10,12H2,1-8H3/b13-11+/t14-,15-,16-,17-,18+,21+,22?,23-/m0/s1
InChIKey BFQWBQIYMSVPOL-ZYXAQXRLSA-N
Mol Weight 396.6 g/mol
Molecular Formula C23H40O5
Exact Mass 396.287574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CYSXNjHUavt
Name Denticulatin B
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H40O5
InChI InChI=1S/C23H40O5/c1-9-11-13(3)12-14(4)20(25)17(7)23(27)18(8)21(26)16(6)22(28-23)15(5)19(24)10-2/h11,14-18,21-22,26-27H,9-10,12H2,1-8H3/b13-11+/t14-,15-,16-,17-,18+,21+,22?,23-/m0/s1
InChIKey BFQWBQIYMSVPOL-ZYXAQXRLSA-N
Molecular Weight 396.568 g/mol
SMILES O[C@@]1([C@@](C(O[C@]([C@@]1(C)[H])([C@](C([C@](C\C(=C\CC)C)(C)[H])=O)(C)[H])O)[C@](C(=O)CC)(C)[H])(C)[H])[H]
SPLASH splash10-0aou-6391000000-652421aeefd6c894e882
Source of Spectrum C-105-7415-0
Synonyms 2,4-Dideoxy-2,4-dimethyl-5-[(1R)-1-methyl-2-oxobutyl]-1-C-[(1R,3S,5E)-1,3,5-trimethyl-2-oxo-5-octenyl]-.alpha.-D-ribopyranose
Wiley ID 1367569