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CHEBI:132442 - chondrochloren B

ChEBI IDCHEBI:132442
ChEBI Namechondrochloren B
Stars
DefinitionA monocarboxylic acid amide with formula C28H42ClNO7, that is produced by Chondromyces crocatus and exhibits antibiotic properties.
Last Modified5 September 2024
Submittergemma
DownloadsMolfile
FormulaC28H42ClNO7
Net Charge0
Average Mass540.097
Monoisotopic Mass539.26498
SMILESCCCC[C@@H](C)[C@H](O)[C@H](C)C(=O)/C(C)=C/[C@@H](OC)[C@@H](O)[C@@H](OCC)C(=O)N/C=C\c1ccc(O)c(Cl)c1
InChIInChI=1S/C28H42ClNO7/c1-7-9-10-17(3)24(32)19(5)25(33)18(4)15-23(36-6)26(34)27(37-8-2)28(35)30-14-13-20-11-12-22(31)21(29)16-20/h11-17,19,23-24,26-27,31-32,34H,7-10H2,1-6H3,(H,30,35)/b14-13-,18-15+/t17-,19+,23-,24+,26-,27-/m1/s1
InChIKeyBIBQKWSSQXEIHK-IRFDLBBPSA-N
Species of MetaboliteComponentSourceComments
Chondromyces crocatus (ncbitaxon:52) - PubMed (19171307)
Roles Classification
Biological Roles:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
chondrochloren B (CHEBI:132442) has role antimicrobial agent (CHEBI:33281)
chondrochloren B (CHEBI:132442) has role bacterial metabolite (CHEBI:76969)
chondrochloren B (CHEBI:132442) is a diol (CHEBI:23824)
chondrochloren B (CHEBI:132442) is a enone (CHEBI:51689)
chondrochloren B (CHEBI:132442) is a ether (CHEBI:25698)
chondrochloren B (CHEBI:132442) is a monocarboxylic acid amide (CHEBI:29347)
chondrochloren B (CHEBI:132442) is a monochlorobenzenes (CHEBI:83403)
chondrochloren B (CHEBI:132442) is a phenols (CHEBI:33853)
chondrochloren B (CHEBI:132442) is a secondary alcohol (CHEBI:35681)
IUPAC Name 
(2R,3R,4R,5E,8S,9S,10R)-N-[(Z)-2-(3-chloro-4-hydroxyphenyl)ethenyl]-2-ethoxy-3,9-dihydroxy-4-methoxy-6,8,10-trimethyl-7-oxotetradec-5-enamide
UniProt Name  Source
chondrochloren BUniProt
Manual XrefsDatabases
CPD-18433MetaCyc
Registry NumbersSources
Reaxys:9531850Reaxys
Citations