CHEBI:66349 - variecolin

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ChEBI Name variecolin ChEBI ID CHEBI:66349 Definition A natural product found in several Aspergillus species. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C25H36O2 Net Charge 0 Average Mass 368.561 Monoisotopic Mass 368.27153 InChI InChI=1S/C25H36O2/c1-15(2)18-8-9-24(4)10-11-25(5)13-19-16(3)12-21(27)22(19)17(14-26)6-7-20(25)23(18)24/h6,14,16,18-20,22-23H,1,7-13H2,2-5H3/b17-6-/t16-,18+,19-,20-,22-,23-,24-,25+/m0/s1 InChIKey XAYQASOMEVLRKN-NOJNFTMQSA-N SMILES [H]C(=O)C1=C/C[C@@]2([H])[C@]3([H])[C@H](CC[C@@]3(C)CC[C@]2(C)C[C@@]2([H])[C@@H](C)CC(=O)[C@@]\12[H])C(C)=C Metabolite of Species Details Aspergillus japonicus (NCBI:txid34381) of strain CAM231 See: PubMed Phoma (NCBI:txid37463) See: JPN PATENT JP 10045662 Aspergillus aurantiobrunneus (NCBI:txid41725) Species also known as Emericella aurantiobrunnea. See: PubMed Aspergillus var.ecolor (NCBI:txid469282) of strain MF 138 See: DOI Aspergillus aculeatus (NCBI:txid5053) of strain KKU-CT2 See: PubMed Aspergillus oryzae (NCBI:txid5062) See: PubMed Roles Classification Biological Role(s): Aspergillus metabolite Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus . chemokine receptor 5 antagonist An antogonist that blocks chemokine receptor 5 (CCR5). View more via ChEBI Ontology ChEBI Ontology Outgoing variecolin (CHEBI:66349) has role Aspergillus metabolite (CHEBI:76956) variecolin (CHEBI:66349) has role chemokine receptor 5 antagonist (CHEBI:63673) variecolin (CHEBI:66349) is a carbotetracyclic compound (CHEBI:177332) variecolin (CHEBI:66349) is a cyclic ketone (CHEBI:3992) variecolin (CHEBI:66349) is a enal (CHEBI:51688) variecolin (CHEBI:66349) is a sesterterpenoid (CHEBI:26660) IUPAC Name (2aS,5S,5aS,5bS,7E,8aR,11S,11aS,12aR)-2a,11,12a-trimethyl-9-oxo-5-(prop-1-en-2-yl)-1,2,2a,3,4,5,5a,5b,6,8a,9,10,11,11a,12,12a-hexadecahydrocyclopenta[4,5]cycloocta[1,2-e]indene-8-carbaldehyde Synonyms Sources (−)-variecolin KNApSAcK variecolin UniProt Manual Xrefs Databases C00033466 KNApSAcK Variecolin Wikipedia View more database links Registry Number Type Source 133101-16-3 CAS Registry Number KNApSAcK Citations Types Sources 11045446 PubMed citation Europe PMC 11463290 PubMed citation Europe PMC 15497939 PubMed citation Europe PMC 24096306 PubMed citation Europe PMC 27806646 PubMed citation Europe PMC 29248948 PubMed citation Europe PMC 29298482 PubMed citation Europe PMC 38261827 PubMed citation Europe PMC Last Modified 17 April 2024