| SpectraBase Spectrum ID |
6ZFM3mChTIJ |
| Name |
13-Oxothalidine |
| Alternate Name(s) |
5,12-dihydroxy-4,13-dimethoxy-17-methyl-17-azatetracyclo[7.6.2.0(2,7).0(10,15)]heptadeca-2,4,6,10,12,14-hexaen-16-one |
| CAS Registry Number |
94707-60-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H19NO5 |
| InChI |
InChI=1S/C19H19NO5/c1-20-13-4-9-5-14(21)16(24-2)7-10(9)18(19(20)23)12-8-17(25-3)15(22)6-11(12)13/h5-8,13,18,21-22H,4H2,1-3H3/t13-,18+/m1/s1 |
| InChIKey |
BIADUOWPJCCXND-ACJLOTCBSA-N |
| Molecular Weight |
341.363 g/mol |
| SMILES |
Oc1c(cc2c([C@@]3(N(C([C@]2(c2cc(c(cc2C3)O)OC)[H])=O)C)[H])c1)OC |
| SPLASH |
splash10-001l-1194000000-83157e1dcf630282df69 |
| Source of Spectrum |
J-50-746-15 |
| Wiley ID |
1335916 |
