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

*Links on SpectraBase are not permalinks.
2-Oxa-11,14-diazatricyclo[15.2.2.13,7]docosa-3,5,7(22),17,19,20-hexaene-12-acetamide, 4-methoxy-10,13-dioxo-, (S)-
SpectraBase Compound ID ktbNBWzoGU
InChI InChI=1S/C22H25N3O5/c1-29-18-8-4-15-5-9-21(27)25-17(13-20(23)26)22(28)24-11-10-14-2-6-16(7-3-14)30-19(18)12-15/h2-4,6-8,12,17H,5,9-11,13H2,1H3,(H2,23,26)(H,24,28)(H,25,27)/t17-/m0/s1
InChIKey UGFVQKRPFRTFJO-KRWDZBQOSA-N
Mol Weight 411.46 g/mol
Molecular Formula C22H25N3O5
Exact Mass 411.179421 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 BzPwFs7RApw
Name 2-Oxa-11,14-diazatricyclo[15.2.2.13,7]docosa-3,5,7(22),17,19,20-hexaene-12-acetamide, 4-methoxy-10,13-dioxo-, (S)-
CAS Registry Number 127559-31-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25N3O5
InChI InChI=1S/C22H25N3O5/c1-29-18-8-4-15-5-9-21(27)25-17(13-20(23)26)22(28)24-11-10-14-2-6-16(7-3-14)30-19(18)12-15/h2-4,6-8,12,17H,5,9-11,13H2,1H3,(H2,23,26)(H,24,28)(H,25,27)/t17-/m0/s1
InChIKey UGFVQKRPFRTFJO-KRWDZBQOSA-N
Molecular Weight 411.458 g/mol
SMILES N1C(CCc2cc(Oc3ccc(CCNC([C@@]1(CC(=O)N)[H])=O)cc3)c(cc2)OC)=O
SPLASH splash10-03di-0017900000-50fb7133eb60cc56371e
Source of Spectrum J-55-6012-104
Synonyms (S)-4-methoxy-12-(2-amino-2-oxothyl)-10,13-dioxo-2-oxa-11,14-diaztricyclo[15.2.2.1]docosa-3,5,7(22),17,19,20-hexaene 2-[(12S)-4-methoxy-10,13-dioxo-2-oxa-11,14-diazatricyclo[15.2.2.1(3,7)]docosa-1(19),3(22),4,6,17,20-hexaen-12-yl]acetamide
Wiley ID 1374093