CHEBI:75291 - ε-rhodomycinone

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ChEBI Name ε-rhodomycinone
ChEBI ID CHEBI:75291
ChEBI ASCII Name epsilon-rhodomycinone
Definition A carboxylic ester that is the methyl ester of (1R,2R,4S)-2-ethyl-2,4,5,7,12-pentahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter KAX
Secondary ChEBI IDs CHEBI:32344
Supplier Information
Download Molfile XML SDF
Formula C22H20O9
Net Charge 0
Average Mass 428.38880
Monoisotopic Mass 428.11073
InChI InChI=1S/C22H20O9/c1-3-22(30)7-10(24)12-13(16(22)21(29)31-2)20(28)14-15(19(12)27)18(26)11-8(17(14)25)5-4-6-9(11)23/h4-6,10,16,23-24,27-28,30H,3,7H2,1-2H3/t10-,16-,22+/m0/s1
InChIKey PYFOXRACBORDCT-GOSXWKPOSA-N
SMILES CC[C@@]1(O)C[C@H](O)c2c(O)c3C(=O)c4c(O)cccc4C(=O)c3c(O)c2[C@H]1C(=O)OC
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via tetracenomycin )
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via tetracenomycin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing ε-rhodomycinone (CHEBI:75291) is a carbopolycyclic compound (CHEBI:35294)
ε-rhodomycinone (CHEBI:75291) is a methyl ester (CHEBI:25248)
ε-rhodomycinone (CHEBI:75291) is a polyphenol (CHEBI:26195)
ε-rhodomycinone (CHEBI:75291) is a tetracenequinones (CHEBI:51286)
ε-rhodomycinone (CHEBI:75291) is a tetracenomycin (CHEBI:48132)
IUPAC Name
methyl (1R,2R,4S)-2-ethyl-2,4,5,7,12-pentahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylate
Synonyms Sources
E-Rhodomycinone ChemIDplus
epsilon-Rhodomycinone KEGG COMPOUND
ε-rhodomycinone UniProt
NSC 196524 ChemIDplus
Rhodomycinone ChemIDplus
Manual Xrefs Databases
C12425 KEGG COMPOUND
CPD-13972 MetaCyc
View more database links
Registry Numbers Types Sources
21288-60-8 CAS Registry Number KEGG COMPOUND
21288-60-8 CAS Registry Number ChemIDplus
2194693 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
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Last Modified
16 March 2015