| SpectraBase Spectrum ID |
6cEtNOeEsK0 |
| Name |
Pentanamide, N-(7-benzoyl-5,8-dioxo-3-phenyl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl)-2-(dimethylamino)-3-methyl-, [3R-[3R*,4S*(2S*,3R*),7S*]]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
582.284220335 u |
| Formula |
C34H38N4O5 |
| InChI |
InChI=1S/C34H38N4O5/c1-5-22(2)29(38(3)4)34(42)37-28-31(25-14-10-7-11-15-25)43-26-18-16-23(17-19-26)20-21-35-32(40)27(36-33(28)41)30(39)24-12-8-6-9-13-24/h6-22,27-29,31H,5H2,1-4H3,(H,35,40)(H,36,41)(H,37,42)/b21-20- |
| InChIKey |
JGTFUPZKTHJDJO-MRCUWXFGSA-N |
| Molecular Weight |
582.701 g/mol |
| SMILES |
CCC(C)C(N(C)C)C(=O)NC1C(OC2=CC=C(\C=C/NC(=O)C(NC1=O)C(=O)C1=CC=CC=C1)C=C2)C1=CC=CC=C1 |
![Pentanamide, N-(7-benzoyl-5,8-dioxo-3-phenyl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl)-2-(dimethylamino)-3-methyl-, [3R-[3R*,4S*(2S*,3R*),7S*]]-](/api/spectrum/6cEtNOeEsK0/structure.png?h=300&w=458 "Pentanamide, N-(7-benzoyl-5,8-dioxo-3-phenyl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl)-2-(dimethylamino)-3-methyl-, [3R-[3R*,4S*(2S*,3R*),7S*]]-")
