EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:220283 - 11-Hydroxy-aclacinomycin T
| Formula | C30H35NO11 |
| Net Charge | 0 |
| Average Mass | 585.606 |
| Monoisotopic Mass | 585.22101 |
| SMILES | CC[C@@]1(O)C[C@H](OC2CC(N(C)C)C(O)C(C)O2)c2c(O)c3c(c(O)c2C1C(=O)OC)C(=O)c1cccc(O)c1C3=O |
| InChI | InChI=1S/C30H35NO11/c1-6-30(39)11-16(42-17-10-14(31(3)4)24(33)12(2)41-17)19-20(23(30)29(38)40-5)28(37)21-22(27(19)36)26(35)18-13(25(21)34)8-7-9-15(18)32/h7-9,12,14,16-17,23-24,32-33,36-37,39H,6,10-11H2,1-5H3/t12?,14?,16-,17?,23?,24?,30+/m0/s1 |
| InChIKey | CVACSAHKWDLUII-LLJDTDHNSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces galilaeus (ncbitaxon:33899) | - | PubMed (8641998) |
| Roles Classification |
|---|
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 11-Hydroxy-aclacinomycin T (CHEBI:220283) is a anthracycline (CHEBI:48120) |
| IUPAC Name |
|---|
| methyl (2R,4S)-4-[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7,12-tetrahydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate |
| Manual Xrefs | Databases |
|---|---|
| 78445622 | ChemSpider |