| SpectraBase Spectrum ID |
5r94MxJ4V5a |
| Name |
(1r,5s,6R,9S,10s,11r,12S,15R)-3-[(4-Nitrobenzoyl)amino]-3-azahexacyclo[7.6.0.0(1,5).0(5,12).0(6,10).0(11,15)]pentadeca-7,13-diene-2,4-dione) |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H15N3O5 |
| InChI |
InChI=1S/C21H15N3O5/c25-17(9-1-3-10(4-2-9)24(28)29)22-23-18(26)20-11-5-6-12-15(11)16-13(20)7-8-14(16)21(12,20)19(23)27/h1-8,11-16H,(H,22,25)/t11-,12+,13+,14-,15-,16+,20-,21- |
| InChIKey |
WROUNJIYIUPZFE-YNHQSRTOSA-N |
| Literature Reference DOI |
10.1002/cmdc.201000306 |
| Molecular Weight |
389.367 g/mol |
| SMILES |
N(N1C(=O)[C@]23[C@]4(C=C[C@]5([C@@]3(C1=O)[C@@]1([C@]([H])([C@@]45[H])[C@]2(C=C1)[H])[H])[H])[H])C(c1ccc(cc1)[N+](=O)[O-])=O |
| SPLASH |
splash10-0fk9-0809000000-82f67a35499cae9c19ef |
| Source of Spectrum |
CMC-5-2072/SM4-7c |
| Wiley ID |
1771668 |
![(1r,5s,6R,9S,10s,11r,12S,15R)-3-[(4-Nitrobenzoyl)amino]-3-azahexacyclo[7.6.0.0(1,5).0(5,12).0(6,10).0(11,15)]pentadeca-7,13-diene-2,4-dione)](/api/spectrum/5r94MxJ4V5a/structure.png?h=300&w=458 "(1r,5s,6R,9S,10s,11r,12S,15R)-3-[(4-Nitrobenzoyl)amino]-3-azahexacyclo[7.6.0.0(1,5).0(5,12).0(6,10).0(11,15)]pentadeca-7,13-diene-2,4-dione)")
