chondrochloren A (CHEBI:132426)

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CHEBI:132426 - chondrochloren A

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ChEBI ID	CHEBI:132426
ChEBI Name	chondrochloren A
Stars
Definition	A monocarboxylic acid amide with formula C₂₇H₄₀ClNO₇, that is produced by Chondromyces crocatus and exhibits antibiotic properties.
Last Modified	3 September 2024
Submitter	gemma
Downloads	Molfile

Formula	C27H40ClNO7
Net Charge	0
Average Mass	526.070
Monoisotopic Mass	525.24933
SMILES	CCCC[C@@H](C)[C@H](O)[C@H](C)C(=O)/C(C)=C/[C@@H](OC)[C@@H](O)[C@@H](OC)C(=O)N/C=C\c1ccc(O)c(Cl)c1
InChI	InChI=1S/C27H40ClNO7/c1-7-8-9-16(2)23(31)18(4)24(32)17(3)14-22(35-5)25(33)26(36-6)27(34)29-13-12-19-10-11-21(30)20(28)15-19/h10-16,18,22-23,25-26,30-31,33H,7-9H2,1-6H3,(H,29,34)/b13-12-,17-14+/t16-,18+,22-,23+,25-,26-/m1/s1
InChIKey	FYBGSKAWXCBCIQ-JRAUAZSASA-N

Species of Metabolite	Component	Source	Comments
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 A (CHEBI:132426) has role antimicrobial agent (CHEBI:33281)
	chondrochloren A (CHEBI:132426) has role bacterial metabolite (CHEBI:76969)
	chondrochloren A (CHEBI:132426) is a diol (CHEBI:23824)
	chondrochloren A (CHEBI:132426) is a enone (CHEBI:51689)
	chondrochloren A (CHEBI:132426) is a ether (CHEBI:25698)
	chondrochloren A (CHEBI:132426) is a monocarboxylic acid amide (CHEBI:29347)
	chondrochloren A (CHEBI:132426) is a monochlorobenzenes (CHEBI:83403)
	chondrochloren A (CHEBI:132426) is a phenols (CHEBI:33853)
	chondrochloren A (CHEBI:132426) is a secondary alcohol (CHEBI:35681)

IUPAC Name
(2R,3R,4R,5E,8S,9S,10R)-N-[(Z)-2-(3-chloro-4-hydroxyphenyl)ethenyl]-3,9-dihydroxy-2,4-dimethoxy-6,8,10-trimethyl-7-oxotetradec-5-enamide

UniProt Name	Source
chondrochloren A	UniProt

Manual Xrefs	Databases
CPD-18432	MetaCyc

Registry Numbers	Sources
Reaxys:9530392	Reaxys

Citations