CHEBI:65643 - Clethramycin

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ChEBI Name Clethramycin
ChEBI ID CHEBI:65643
Definition A natural product found in Streptomyces hygroscopicus and Streptomyces mediocidicus.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C63H99N3O18S
Net Charge 0
Average Mass 1218.53400
Monoisotopic Mass 1217.66443
InChI InChI=1S/C63H99N3O18S/c1-45(27-19-15-11-10-12-16-20-28-46(2)62(79)80)61(78)48(4)58(76)36-21-17-13-8-6-5-7-9-14-18-22-37-60(84-85(81,82)83)47(3)59(77)44-57(75)43-54(72)34-25-33-53(71)42-56(74)41-52(70)32-24-31-50(68)39-49(67)29-23-30-51(69)40-55(73)35-26-38-66-63(64)65/h5-10,12-14,16-25,27-29,32,34,36,45,47-58,60-61,67-76,78H,11,15,26,30-31,33,35,37-44H2,1-4H3,(H,79,80)(H4,64,65,66)(H,81,82,83)/b7-5+,8-6+,12-10+,14-9+,17-13+,20-16+,22-18+,27-19+,29-23+,32-24+,34-25+,36-21+,46-28+/t45?,47?,48-,49+,50+,51+,52+,53-,54-,55-,56-,57-,58+,60?,61-/m0/s1
InChIKey OQRILZSNZMAVTK-OLZSDPFHSA-N
SMILES CC(\C=C\CC\C=C\C=C\C=C(/C)C(O)=O)[C@H](O)[C@@H](C)[C@H](O)\C=C\C=C\C=C\C=C\C=C\C=C\CC(OS(O)(=O)=O)C(C)C(=O)C[C@@H](O)C[C@@H](O)\C=C\C[C@H](O)C[C@@H](O)C[C@H](O)\C=C\C[C@@H](O)C[C@H](O)\C=C\C[C@@H](O)C[C@@H](O)CCCNC(N)=N
Metabolite of Species Details
Streptomyces hygroscopicus (NCBI:txid1912) syn/anti relative stereochemistry of strain TP A0623 See: PubMed
Streptomyces mediocidicus (NCBI:txid58352) syn/anti relative stereochemistry of strain ATCC23936 See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Clethramycin (CHEBI:65643) has role metabolite (CHEBI:25212)
Clethramycin (CHEBI:65643) is a ultra-long-chain fatty acid (CHEBI:143004)
Synonym Source
58-carbamimidamido-13,15,33,35,39,41,43,47,49,53,55-undecahydroxy-2,12,14,30-tetramethyl-31-oxo-29-(sulfooxy)octapentaconta-2,4,6,10,16,18,20,22,24,26,36,44,50-tridecaenoic acid ChEBI
Citations Waiting for Citations Types Sources
14563159 PubMed citation Europe PMC
17315962 PubMed citation Europe PMC
Last Modified
30 January 2019
General Comment
2014-10-17 Suggested Classification: ISA:hydroxy fatty acid(CHEBI:24654); ISA:alkyl sulfate(CHEBI:29281); ISA:fatty acid derivative(CHEBI:61697); ISA:methyl-branched fatty acid(CHEBI:62499); ISA:sulfuric ester(CHEBI:26819); ISA:2-oxo aldehyde(CHEBI:27659); ISA:beta-hydroxy ketone(CHEBI:55380); ISA:unsaturated fatty acid(CHEBI:27208); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:polyol(CHEBI:26191); ISA:guanidines(CHEBI:24436); ISA:secondary alcohol(CHEBI:35681); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352); ISA:monocarboxylic acid(CHEBI:25384); ISA:amine(CHEBI:32952); ISA:imine(CHEBI:24783);