For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3,7-Secoisorhynchophylline
SpectraBase Compound ID F8DCY1dMt64
InChI InChI=1S/C22H28N2O5/c1-4-14-12-24(20(25)11-17(14)18(13-28-2)22(27)29-3)10-9-16-15-7-5-6-8-19(15)23-21(16)26/h5-8,13-14,16-17H,4,9-12H2,1-3H3,(H,23,26)/b18-13-/t14-,16?,17-/m0/s1
InChIKey OCVUAVWMIPOCML-QGKKCXKDSA-N
Mol Weight 400.48 g/mol
Molecular Formula C22H28N2O5
Exact Mass 400.199822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AO9d0OFm6LV
Name 3,7-Secoisorhynchophylline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28N2O5
InChI InChI=1S/C22H28N2O5/c1-4-14-12-24(20(25)11-17(14)18(13-28-2)22(27)29-3)10-9-16-15-7-5-6-8-19(15)23-21(16)26/h5-8,13-14,16-17H,4,9-12H2,1-3H3,(H,23,26)/b18-13-/t14-,16?,17-/m0/s1
InChIKey OCVUAVWMIPOCML-QGKKCXKDSA-N
Molecular Weight 400.475 g/mol
SMILES N1c2c(C(C1=O)CCN1C[C@@]([C@@](\C(C(=O)OC)=C\OC)(CC1=O)[H])(CC)[H])cccc2
SPLASH splash10-0udi-0050900000-34b1c0e9c48c522249cb
Source of Spectrum F-55-6845-4
Synonyms Methyl (2Z)-2-{(4S,5R)-5-ethyl-2-oxo-1-[2-(2-oxo-2,3-dihydro-1H-indol-3-yl)ethyl]piperidinyl}-3-methoxy-2-propenoate
Wiley ID 837971