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(6E,7S,8R,8aS)-6-[(E,2R,6R,7R)-2,5-dimethyl-6,7-bis(oxidanyl)oct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol

View entire compound with spectra: 1 MS (GC)

(6E,7S,8R,8aS)-6-[(E,2R,6R,7R)-2,5-dimethyl-6,7-bis(oxidanyl)oct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol
SpectraBase Compound ID ISFf2To6ZzH
InChI InChI=1S/C19H33NO4/c1-12(7-8-13(2)17(22)14(3)21)10-15-11-20-9-5-6-16(20)19(4,24)18(15)23/h8,10,12,14,16-18,21-24H,5-7,9,11H2,1-4H3/b13-8+,15-10+/t12-,14-,16+,17-,18+,19-/m1/s1
InChIKey ROTIYIHXOAYCEN-GANWWIDTSA-N
Mol Weight 339.5 g/mol
Molecular Formula C19H33NO4
Exact Mass 339.240959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9RUgFUbNWGz
Name (6E,7S,8R,8aS)-6-[(E,2R,6R,7R)-2,5-dimethyl-6,7-bis(oxidanyl)oct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol
CAS Registry Number 91550-04-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H33NO4
InChI InChI=1S/C19H33NO4/c1-12(7-8-13(2)17(22)14(3)21)10-15-11-20-9-5-6-16(20)19(4,24)18(15)23/h8,10,12,14,16-18,21-24H,5-7,9,11H2,1-4H3/b13-8+,15-10+/t12-,14-,16+,17-,18+,19-/m1/s1
InChIKey ROTIYIHXOAYCEN-GANWWIDTSA-N
Molecular Weight 339.476 g/mol
SMILES O[C@]1([C@](\C(=C\[C@@](C\C=C\([C@]([C@](O)(C)[H])(O)[H])C)(C)[H])CN2[C@]1(CCC2)[H])(O)[H])C
SPLASH splash10-00e9-6900000000-83f74e5343f82dc48352
Source of Spectrum J-57-1189-9
Synonyms (6E,7S,8R,8aS)-6-[(E,2R,6R,7R)-6,7-dihydroxy-2,5-dimethyl-oct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol (6E,7S,8R,8aS)-6-[(E,2R,6R,7R)-6,7-dihydroxy-2,5-dimethyl-oct-4-enylidene]-8-methyl-indolizidine-7,8-diol
Wiley ID 1334519