CHEBI:71537 - (1'S,5'S)-averufin

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ChEBI Name (1'S,5'S)-averufin
ChEBI ASCII Name (1'S,5'S)-averufin
Definition An organic heteropentacyclic compound that is 3,4,5,6-tetrahydro-2H-2,6-epoxyanthra[2,3-b]oxocine-8,13-dione substituted at position 2 by a methyl group and at positions 7, 9 and 11 by hydroxy groups (the S,S-diastereomer)
Stars This entity has been manually annotated by the ChEBI Team.
Submitter KAX
Supplier Information
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Formula C20H16O7
Net Charge 0
Average Mass 368.33680
Monoisotopic Mass 368.08960
InChI InChI=1S/C20H16O7/c1-20-4-2-3-12(26-20)16-13(27-20)7-10-15(19(16)25)18(24)14-9(17(10)23)5-8(21)6-11(14)22/h5-7,12,21-22,25H,2-4H2,1H3/t12-,20-/m0/s1
SMILES [H][C@]12CCC[C@](C)(Oc3cc4C(=O)c5cc(O)cc(O)c5C(=O)c4c(O)c13)O2
Roles Classification
Biological Role(s): fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
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ChEBI Ontology
Outgoing (1'S,5'S)-averufin (CHEBI:71537) has role fungal metabolite (CHEBI:76946)
(1'S,5'S)-averufin (CHEBI:71537) is a cyclic ketal (CHEBI:59779)
(1'S,5'S)-averufin (CHEBI:71537) is a organic heteropentacyclic compound (CHEBI:38164)
(1'S,5'S)-averufin (CHEBI:71537) is a polyketide (CHEBI:26188)
(1'S,5'S)-averufin (CHEBI:71537) is a polyphenol (CHEBI:26195)
Synonym Source
(1'S,5'S)-averufin UniProt
Manual Xref Database
CPD-10167 MetaCyc
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Registry Numbers Types Sources
14016-29-6 CAS Registry Number ChemIDplus
5310443 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
20195823 PubMed citation Europe PMC
8368836 PubMed citation SUBMITTER
Last Modified
05 August 2014