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Seneciphylline
SpectraBase Compound ID 6qszLYsnwk7
InChI InChI=1S/C18H23NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,12,14-15,22H,1-2,6-10H2,3H3/t12?,14-,15-,18-/m1/s1
InChIKey CEFXJFQWOLCTAG-HMWWLYAWSA-N
Mol Weight 333.38 g/mol
Molecular Formula C18H23NO5
Exact Mass 333.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EZNSRTsFT9T
Name Seneciphylline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO5
InChI InChI=1S/C18H23NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,12,14-15,22H,1-2,6-10H2,3H3/t12?,14-,15-,18-/m1/s1
InChIKey CEFXJFQWOLCTAG-HMWWLYAWSA-N
Literature Reference DOI 10.1002/cbdv.201600155
Molecular Weight 333.384 g/mol
SMILES O[C@]1(C(OCC=2[C@@]3([C@](OC(C(C=C)CC1=C)=O)(CCN3CC2)[H])[H])=O)C
SPLASH splash10-0076-7900000000-96dd7bfb477d2b7b8c66
Source of Spectrum CBD-14-8-14
Synonyms (6R,9a1R,14aR)-6-hydroxy-6-methyl-5-methylene-3-vinyl-3,4,5,6,9,9a1,11,13,14,14a-decahydro-[1,6]dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione
Wiley ID 1806339