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(2R,3S,4S,5R,6R,10S,11R,12R,13R)-13-Ethyl-6,11-dihydroxy-3,5-O-(isopropylidenedioxy)-2,4,6,8,10,12-hexamethyl-8(E)-tridecenolide

View entire compound with spectra: 1 MS (GC)

(2R,3S,4S,5R,6R,10S,11R,12R,13R)-13-Ethyl-6,11-dihydroxy-3,5-O-(isopropylidenedioxy)-2,4,6,8,10,12-hexamethyl-8(E)-tridecenolide
SpectraBase Compound ID LvyTg8qhJnm
InChI InChI=1S/C24H42O6/c1-10-18-15(4)19(25)14(3)11-13(2)12-24(9,27)21-16(5)20(17(6)22(26)28-18)29-23(7,8)30-21/h11,14-21,25,27H,10,12H2,1-9H3/b13-11+/t14-,15-,16-,17+,18+,19+,20-,21+,24+/m0/s1
InChIKey JKKCVABHHISHND-NFXKJCGISA-N
Mol Weight 426.6 g/mol
Molecular Formula C24H42O6
Exact Mass 426.298139 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 16jMWYtVm7l
Name (2R,3S,4S,5R,6R,10S,11R,12R,13R)-13-Ethyl-6,11-dihydroxy-3,5-O-(isopropylidenedioxy)-2,4,6,8,10,12-hexamethyl-8(E)-tridecenolide
Alternate Name(s) (1S,2R,5R,6R,7R,8S,9E,12R,13R,17S)-5-ethyl-7,12-dihydroxy-2,6,8,10,12,15,15,17-octamethyl-4,14,16-trioxabicyclo[11.3.1]heptadec-9-en-3-one (2R,3S,4S,5R,6R,10S,11R,12R,13R)-13-ethyl-6,11-dihydroxy-3,5-O-(isopropylidenedioxy)-2,4,6,8,10,12-hexamethyl-8(E)-tredecenolide
CAS Registry Number 131589-35-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H42O6
InChI InChI=1S/C24H42O6/c1-10-18-15(4)19(25)14(3)11-13(2)12-24(9,27)21-16(5)20(17(6)22(26)28-18)29-23(7,8)30-21/h11,14-21,25,27H,10,12H2,1-9H3/b13-11+/t14-,15-,16-,17+,18+,19+,20-,21+,24+/m0/s1
InChIKey JKKCVABHHISHND-NFXKJCGISA-N
Molecular Weight 426.594 g/mol
SMILES O[C@]1([C@]([C@](OC([C@@]([C@@]2([C@@]([C@]([C@@](C\C(=C\[C@@]1(C)[H])C)(O)C)(OC(O2)(C)C)[H])(C)[H])[H])(C)[H])=O)(CC)[H])(C)[H])[H]
SPLASH splash10-00ko-9210000000-8dd90f219614ed5ae4f3
Source of Spectrum C-113-922-51
Wiley ID 1379982