CHEBI:220424 - 7-deoxyauramycinone

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 7-deoxyauramycinone
ChEBI ID CHEBI:220424
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H18O7
Net Charge 0
Average Mass 382.368
Monoisotopic Mass 382.10525
InChI InChI=1S/C21H18O7/c1-21(27)7-6-9-11(16(21)20(26)28-2)8-12-15(18(9)24)19(25)14-10(17(12)23)4-3-5-13(14)22/h3-5,8,16,22,24,27H,6-7H2,1-2H3/t16-,21+/m0/s1
InChIKey JYCCDRRKNCZUQA-HRAATJIYSA-N
SMILES O=C1C2=C(O)C3=C([C@@H](C(=O)OC)[C@@](O)(C)CC3)C=C2C(=O)C=4C1=C(O)C=CC4
Metabolite of Species Details
Streptomyces nogalater (NCBI:txid38314) See: PubMed
ChEBI Ontology
Outgoing 7-deoxyauramycinone (CHEBI:220424) is a quinone (CHEBI:36141)
7-deoxyauramycinone (CHEBI:220424) is a tetracenes (CHEBI:51270)
IUPAC Name
methyl (1R,2R)-2,5,7-trihydroxy-2-methyl-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate
Manual Xref Database
8747328 ChemSpider
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