CHEBI:226286 - Udalactarane A

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Udalactarane A
ChEBI ID CHEBI:226286
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H30O4
Net Charge 0
Average Mass 346.467
Monoisotopic Mass 346.21441
InChI InChI=1S/C21H30O4/c1-5-13(2)6-7-24-18-21-12-20(21,17(23)25-18)9-14-8-19(3,4)10-15(14)16(21)11-22/h11,13-14,18H,5-10,12H2,1-4H3/t13?,14-,18-,20+,21+/m0/s1
InChIKey CERWTWXWRVGAAK-WSGFHQMUSA-N
SMILES O=C1O[C@H](OCCC(CC)C)[C@]23[C@]1(C[C@@H]4CC(C)(C)CC4=C2C=O)C3
Metabolite of Species Details
Phlebia uda (NCBI:txid98779) See: PubMed
ChEBI Ontology
Outgoing Udalactarane A (CHEBI:226286) is a δ-lactone (CHEBI:18946)
IUPAC Name
(1S,7S,9S,12S)-5,5-dimethyl-12-(3-methylpentoxy)-10-oxo-11-oxatetracyclo[7.3.1.01,9.03,7]tridec-2-ene-2-carbaldehyde
Manual Xref Database
32679286 ChemSpider
View more database links