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CHEBI:230426 - 4-Dedimethylamino sancycline
| Formula | C19H17NO7 |
| Net Charge | 0 |
| Average Mass | 371.345 |
| Monoisotopic Mass | 371.10050 |
| SMILES | NC(=O)C1=C(O)[C@@]2(O)C(=O)C3=C(O)c4c(O)cccc4CC3CC2CC1=O |
| InChI | InChI=1S/C19H17NO7/c20-18(26)14-11(22)6-9-5-8-4-7-2-1-3-10(21)12(7)15(23)13(8)16(24)19(9,27)17(14)25/h1-3,8-9,21,23,25,27H,4-6H2,(H2,20,26)/t8?,9?,19-/m0/s1 |
| InChIKey | NBRQRXRBIHVLGI-LANRQRAVSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS9100) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-Dedimethylamino sancycline (CHEBI:230426) is a organic molecular entity (CHEBI:50860) |
| IUPAC Name |
|---|
| (12aR)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide |
| Manual Xrefs | Databases |
|---|---|
| 110806268 | ChemSpider |