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(rel 5S,6S,8R,9R,10S)-6-Acetoxy-9-hydroxy-15-methoxy-13(14)-labden-16,15-olide
SpectraBase Compound ID K7yD0VmoLCY
InChI InChI=1S/C23H36O6/c1-14-12-17(28-15(2)24)19-21(3,4)9-7-10-22(19,5)23(14,26)11-8-16-13-18(27-6)29-20(16)25/h13-14,17-19,26H,7-12H2,1-6H3/t14-,17+,18?,19+,22+,23-/m1/s1
InChIKey JCLASDLCCPVVAB-JMXAXGPJSA-N
Mol Weight 408.5 g/mol
Molecular Formula C23H36O6
Exact Mass 408.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JfprCl6RWQY
Name (rel 5S,6S,8R,9R,10S)-6-Acetoxy-9-hydroxy-15-methoxy-13(14)-labden-16,15-olide
Alternate Name(s) (1S,3R,4R,4aS,8aS)-4-hydroxy-4-[2-(5-methoxy-2-oxo-2,5-dihydro-3-furanyl)ethyl]-3,4a,8,8-tetramethyldecahydro-1-naphthalenyl acetate (rel 5S,6R,8R,9R,10S)-6-Acetoxy-9-hydroxy-15-methoxy-13(14)-labden-16,15-olide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O6
InChI InChI=1S/C23H36O6/c1-14-12-17(28-15(2)24)19-21(3,4)9-7-10-22(19,5)23(14,26)11-8-16-13-18(27-6)29-20(16)25/h13-14,17-19,26H,7-12H2,1-6H3/t14-,17+,18?,19+,22+,23-/m1/s1
InChIKey JCLASDLCCPVVAB-JMXAXGPJSA-N
Molecular Weight 408.535 g/mol
SMILES O[C@]1([C@@]2([C@@]([C@](C[C@]1(C)[H])(OC(=O)C)[H])(C(C)(C)CCC2)[H])C)CCC=1C(OC(C1)OC)=O
SPLASH splash10-000b-0902000000-75b9047a2a2a8f4aa1a7
Source of Spectrum E2-49-85-3
Wiley ID 1555568