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Allopumiliotoxin 323 B'
SpectraBase Compound ID C9Sw3t5k4ku
InChI InChI=1S/C19H33NO3/c1-5-16(21)14(3)9-8-13(2)11-15-12-20-10-6-7-17(20)19(4,23)18(15)22/h9,11,13,16-18,21-23H,5-8,10,12H2,1-4H3/b14-9+,15-11+
InChIKey DQSBNMJLDZIARX-YFVJMOTDSA-N
Mol Weight 323.5 g/mol
Molecular Formula C19H33NO3
Exact Mass 323.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CgWJctFECHG
Name (6E)-6-[(E)-2,5-dimethyl-6-oxidanyl-oct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol
CAS Registry Number 92216-55-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H33NO3
InChI InChI=1S/C19H33NO3/c1-5-16(21)14(3)9-8-13(2)11-15-12-20-10-6-7-17(20)19(4,23)18(15)22/h9,11,13,16-18,21-23H,5-8,10,12H2,1-4H3/b14-9+,15-11+
InChIKey DQSBNMJLDZIARX-YFVJMOTDSA-N
Molecular Weight 323.477 g/mol
SMILES OC1(C(\C(CN2C1CCC2)=C\C(C\C=C\(C(O)CC)C)C)O)C
SPLASH splash10-00e9-9601000000-2e15cee247e127a30098
Source of Spectrum X2-68-1556-1575
Synonyms (6E)-6-[(E)-6-hydroxy-2,5-dimethyl-oct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol (6E)-6-[(E)-6-hydroxy-2,5-dimethyl-oct-4-enylidene]-8-methyl-indolizidine-7,8-diol
Wiley ID 1610283