EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:31359 - carminomycin
| Formula | C26H27NO10 |
| Net Charge | 0 |
| Average Mass | 513.499 |
| Monoisotopic Mass | 513.16350 |
| SMILES | CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](N)[C@H](O)[C@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O |
| InChI | InChI=1S/C26H27NO10/c1-9-21(30)13(27)6-16(36-9)37-15-8-26(35,10(2)28)7-12-18(15)25(34)20-19(23(12)32)22(31)11-4-3-5-14(29)17(11)24(20)33/h3-5,9,13,15-16,21,29-30,32,34-35H,6-8,27H2,1-2H3/t9-,13-,15-,16-,21+,26-/m0/s1 |
| InChIKey | XREUEWVEMYWFFA-CSKJXFQVSA-N |
| Roles Classification |
|---|
| Biological Roles: | apoptosis inducer Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms. antimicrobial agent A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. antimicrobial agent A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| Application: | antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| carminomycin (CHEBI:31359) has parent hydride tetracene (CHEBI:32600) |
| carminomycin (CHEBI:31359) has role antineoplastic agent (CHEBI:35610) |
| carminomycin (CHEBI:31359) has role apoptosis inducer (CHEBI:68495) |
| carminomycin (CHEBI:31359) is a p-quinones (CHEBI:25830) |
| carminomycin (CHEBI:31359) is a aminoglycoside antibiotic (CHEBI:22507) |
| carminomycin (CHEBI:31359) is a anthracycline antibiotic (CHEBI:49322) |
| carminomycin (CHEBI:31359) is a tertiary α-hydroxy ketone (CHEBI:139592) |
| carminomycin (CHEBI:31359) is a tetracenequinones (CHEBI:51286) |
| carminomycin (CHEBI:31359) is conjugate base of carminomycin(1+) (CHEBI:75730) |
| Incoming Relation(s) |
| (13R)-13-dihydrocarminomycin (CHEBI:31058) has functional parent carminomycin (CHEBI:31359) |
| 10-carboxy-13-deoxycarminomycin (CHEBI:31047) has functional parent carminomycin (CHEBI:31359) |
| carminomycin(1+) (CHEBI:75730) is conjugate acid of carminomycin (CHEBI:31359) |
| IUPAC Name |
|---|
| (1S,3S)-3-acetyl-3,5,10,12-tetrahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-α-L-lyxo-hexopyranoside |
| Synonyms | Source |
|---|---|
| Karminomycin | ChemIDplus |
| O-Demethyldaunomycin | ChemIDplus |
| CCRIS 961 | ChemIDplus |
| carubicin | MetaCyc |
| Manual Xrefs | Databases |
|---|---|
| C12432 | KEGG COMPOUND |
| US2006100421 | Patent |
| WO2006104668 | Patent |
| CPD-15734 | MetaCyc |
| 510 | DrugCentral |
| Registry Numbers | Sources |
|---|---|
| Reaxys:1674904 | Reaxys |
| CAS:39472-31-6 | KEGG COMPOUND |
| CAS:39472-31-6 | ChemIDplus |
| Citations |
|---|