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Ratjadone
SpectraBase Compound ID Kf0EhXTvbVy
InChI InChI=1S/C28H40O5/c1-6-9-26-22(5)25(30)18-27(33-26)24(29)12-7-10-19(2)16-21(4)17-20(3)14-15-23-11-8-13-28(31)32-23/h6-10,12-15,17,21-27,29-30H,11,16,18H2,1-5H3/b9-6+,12-7+,15-14+,19-10+,20-17-/t21?,22-,23?,24-,25+,26-,27-/m1/s1
InChIKey CAYGMWMWJUFODP-NJDBPASGSA-N
Mol Weight 456.6 g/mol
Molecular Formula C28H40O5
Exact Mass 456.287574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8P1GtPcAyDx
Name Ratjadone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H40O5
InChI InChI=1S/C28H40O5/c1-6-9-26-22(5)25(30)18-27(33-26)24(29)12-7-10-19(2)16-21(4)17-20(3)14-15-23-11-8-13-28(31)32-23/h6-10,12-15,17,21-27,29-30H,11,16,18H2,1-5H3/b9-6+,12-7+,15-14+,19-10+,20-17-/t21?,22-,23?,24-,25+,26-,27-/m1/s1
InChIKey CAYGMWMWJUFODP-NJDBPASGSA-N
Molecular Weight 456.623 g/mol
SMILES O[C@@]([C@]1(C[C@@]([C@]([C@](O1)(\C=C\C)[H])(C)[H])(O)[H])[H])(\C=C\C=C\(CC(\C=C/(\C=C\C1OC(=O)C=CC1)C)C)C)[H]
SPLASH splash10-0005-0900000000-f100d6b99f587cf66f20
Source of Spectrum U-1995-687-1
Synonyms 6-[(1E,3Z,7E,9E,11R)-11-hydroxy-11-[(2R,4S,5R,6R)-4-hydroxy-5-methyl-6-[(1E)-prop-1-en-1-yl]oxan-2-yl]-3,5,7-trimethylundeca-1,3,7,9-tetraen-1-yl]-5,6-dihydro-2H-pyran-2-one
Wiley ID 766578