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Lysergol-.beta.,D-galactoside

View entire compound with spectra: 1 MS (GC)

Lysergol-.beta.,D-galactoside
SpectraBase Compound ID 4gXICdiYT7f
InChI InChI=1S/C22H28N2O6/c1-24-8-11(10-29-22-21(28)20(27)19(26)17(9-25)30-22)5-14-13-3-2-4-15-18(13)12(7-23-15)6-16(14)24/h2-5,7,11,16-17,19-23,25-28H,6,8-10H2,1H3/t11-,16-,17-,19+,20+,21-,22-/m1/s1
InChIKey PNWPXMYYLYEFLR-SASGOCEXSA-N
Mol Weight 416.47 g/mol
Molecular Formula C22H28N2O6
Exact Mass 416.194737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LhMHUDl7EmF
Name Lysergol-.beta.,D-galactoside
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28N2O6
InChI InChI=1S/C22H28N2O6/c1-24-8-11(10-29-22-21(28)20(27)19(26)17(9-25)30-22)5-14-13-3-2-4-15-18(13)12(7-23-15)6-16(14)24/h2-5,7,11,16-17,19-23,25-28H,6,8-10H2,1H3/t11-,16-,17-,19+,20+,21-,22-/m1/s1
InChIKey PNWPXMYYLYEFLR-SASGOCEXSA-N
Molecular Weight 416.474 g/mol
SMILES O[C@]1([C@]([C@](O[C@]([C@@]1(O)[H])(OC[C@@]1(C=C2[C@](N(C)C1)(Cc1c3c2cccc3[nH]c1)[H])[H])[H])(CO)[H])(O)[H])[H]
SPLASH splash10-014i-1340900000-3f1c56e5b874f7b248fb
Source of Spectrum AT-33-7236-6
Synonyms [(8beta)-6-methyl-9,10-didehydroergolin-8-yl]methyl .beta.-D-galactopyranoside (2R,3R,4S,5R,6R)-2-[[(6aR,9R)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-yl]methoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol (2R,3R,4S,5R,6R)-2-[[(6aR,9R)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Wiley ID 852342