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(1.alpha.,2.alpha.,3.alpha.,4.alpha.,5.alpha.,6.alpha.,7.alpha.,8.alpha.,9.alpha.,10.alpha.,13.alpha.,14.alpha.)-4,5-Di(acetoxymethyl)-10,13-dihydroxypentacyclo[6.6.2.2(3,6).0(2,7).0(9,14)]octadeca-11,15,17-triene
SpectraBase Compound ID JhwlKxppkML
InChI InChI=1S/C24H30O6/c1-11(25)29-9-17-13-3-4-14(18(17)10-30-12(2)26)22-16-6-5-15(21(13)22)23-19(27)7-8-20(28)24(16)23/h3-8,13-24,27-28H,9-10H2,1-2H3/t13-,14+,15-,16+,17-,18+,19+,20-,21-,22+,23-,24+
InChIKey DHRNVBASECYUJR-FUPPSQEBSA-N
Mol Weight 414.5 g/mol
Molecular Formula C24H30O6
Exact Mass 414.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8rMuVecExRX
Name (1.alpha.,2.alpha.,3.alpha.,4.alpha.,5.alpha.,6.alpha.,7.alpha.,8.alpha.,9.alpha.,10.alpha.,13.alpha.,14.alpha.)-4,5-Di(acetoxymethyl)-10,13-dihydroxypentacyclo[6.6.2.2(3,6).0(2,7).0(9,14)]octadeca-11,15,17-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30O6
InChI InChI=1S/C24H30O6/c1-11(25)29-9-17-13-3-4-14(18(17)10-30-12(2)26)22-16-6-5-15(21(13)22)23-19(27)7-8-20(28)24(16)23/h3-8,13-24,27-28H,9-10H2,1-2H3/t13-,14+,15-,16+,17-,18+,19+,20-,21-,22+,23-,24+
InChIKey DHRNVBASECYUJR-FUPPSQEBSA-N
Molecular Weight 414.498 g/mol
SMILES O[C@@]1(C=C[C@@]([C@@]2([C@]1([C@@]1([C@]3([C@@]([C@]2(C=C1)[H])([C@@]1(C=C[C@@]3([H])[C@@]([C@@]1(COC(=O)C)[H])(COC(=O)C)[H])[H])[H])[H])[H])[H])[H])(O)[H])[H]
SPLASH splash10-004l-0090000000-80b0244183b77cacab9a
Source of Spectrum F-51-2919-22
Synonyms {(1R,2R,3S,4R,5S,6R,7S,8S,9R,10R,13S,14S)-5-[(acetyloxy)methyl]-10,13-dihydroxypentacyclo[6.6.2.2(3,6).0(2,7).0(9,14)]octadeca-11,15,17-trien-4-yl}methyl acetate
Wiley ID 791385