Term: | doxorubicin |
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Accession: | CHEBI:28748
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Definition: | An anthracycline antibiotic that has formula C27H29NO11. |
Synonyms: | exact_synonym: | (1S,3S)-3,5,12-trihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside |
| related_synonym: | (1S,3S)-3-glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside; (8S-cis)-10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-5,12-naphthacenedione; 14-hydroxydaunomycin; 14-hydroxydaunorubicine; Adriamycin; Formula=C27H29NO11; InChI=1S/C27H29NO11/c1-10-22(31)13(28)6-17(38-10)39-15-8-27(36,16(30)9-29)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34/h3-5,10,13,15,17,22,29,31,33,35-36H,6-9,28H2,1-2H3/t10-,13-,15-,17-,22+,27-/m0/s1; InChIKey=AOJJSUZBOXZQNB-TZSSRYMLSA-N; SMILES=COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)CO; doxorubicine; doxorubicinum |
| alt_id: | CHEBI:22270; CHEBI:2496; CHEBI:42031 |
| xref: | CAS:23214-92-8; DrugBank:DB00997; Drug_Central:960; KEGG:C01661; KEGG:D03899; LINCS:LSM-4062; LIPID_MAPS_instance:LMPK13050001 |
| xref_mesh: | MESH:D004317 |
| xref: | PDBeChem:DM2 |
| cyclic_relationship: | is_conjugate_base_of CHEBI:64816 |
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