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Pumiliotoxin A
SpectraBase Compound ID EoHOdrCCKs0
InChI InChI=1S/C19H33NO2/c1-5-17(21)15(3)9-8-14(2)11-16-12-19(4,22)18-7-6-10-20(18)13-16/h9,13-14,17-18,21-22H,5-8,10-12H2,1-4H3/b15-9+/t14-,17?,18?,19+/m1/s1
InChIKey CAELHZYUFCDHCW-HIWAEKCTSA-N
Mol Weight 307.5 g/mol
Molecular Formula C19H33NO2
Exact Mass 307.251129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qvSbxIKCop
Name Pumiliotoxin A
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H33NO2
InChI InChI=1S/C19H33NO2/c1-5-17(21)15(3)9-8-14(2)11-16-12-19(4,22)18-7-6-10-20(18)13-16/h9,13-14,17-18,21-22H,5-8,10-12H2,1-4H3/b15-9+/t14-,17?,18?,19+/m1/s1
InChIKey CAELHZYUFCDHCW-HIWAEKCTSA-N
Molecular Weight 307.478 g/mol
SMILES OC(\C(=C\C[C@](CC1=CN2C([C@](C1)(O)C)CCC2)(C)[H])C)CC
SPLASH splash10-006x-5910000000-fd402e2c8def88b37c63
Source of Spectrum X2-68-1556-1575
Synonyms 6-Methyl-6-hydroxy-8-[2',5'-dimethyl-6'-hydroxy-4'-octylidene]-1-azabicyclo[4.3.0]non-8-ene
Wiley ID 1610240