CHEBI:64418 - austinol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name austinol
Definition A meroterpenoid produced by Aspergillus nidulans. It has a pentacyclic structure which incorporates three lactone functionalities and a spiro union.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C25H30O8
Net Charge 0
Average Mass 458.50090
Monoisotopic Mass 458.19407
InChI InChI=1S/C25H30O8/c1-12-16-17(27)22(7)13(2)24(18(28)31-14(3)25(24,30)19(29)33-22)21(16,6)10-11-23(12)9-8-15(26)32-20(23,4)5/h8-9,14,17,27,30H,2,10-11H2,1,3-7H3/t14-,17+,21+,22+,23+,24+,25-/m0/s1
SMILES C[C@@H]1OC(=O)[C@@]23C(=C)[C@@](C)(OC(=O)[C@@]12O)[C@H](O)C1=C(C)[C@]2(CC[C@@]31C)C=CC(=O)OC2(C)C
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via meroterpenoid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing austinol (CHEBI:64418) is a meroterpenoid (CHEBI:64419)
Manual Xrefs Databases
FDB012873 FooDB
HMDB0034464 HMDB
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Registry Numbers Types Sources
6832416 Reaxys Registry Number Reaxys
72040-27-8 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
18978088 PubMed citation Europe PMC
21601895 PubMed citation Europe PMC
21658102 PubMed citation Europe PMC
22329759 PubMed citation Europe PMC
Last Modified
18 August 2020