| SpectraBase Spectrum ID |
2HGDUKTjc8A |
| Name |
Sodium aristolochate-I |
| Alternate Name(s) |
sodium 8-methoxy-6-nitrophenanthro[3,4-d][1,3]dioxole-5-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H10NNaO7 |
| InChI |
InChI=1S/C17H11NO7.Na/c1-23-12-4-2-3-8-9(12)5-11(18(21)22)14-10(17(19)20)6-13-16(15(8)14)25-7-24-13;/h2-6H,7H2,1H3,(H,19,20);/q;+1/p-1 |
| InChIKey |
BQVOPWJSBBMGBR-UHFFFAOYSA-M |
| Literature Reference DOI |
10.1002/jccs.200700187 |
| Molecular Weight |
363.257 g/mol |
| SMILES |
c12cc(c3c(c2OCO1)c1c(cc3[N+]([O-])=O)c(ccc1)OC)C([O-])=O.[Na+] |
| SPLASH |
splash10-0kaj-9050000000-006e29f1666af159d748 |
| Source of Spectrum |
QA-54-1331-10 |
| Wiley ID |
1796329 |
