CHEBI:202912 - Cladospolide C

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 Cladospolide C
ChEBI ID CHEBI:202912
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H20O4
Net Charge 0
Average Mass 228.288
Monoisotopic Mass 228.13616
InChI InChI=1S/C12H20O4/c1-9-5-3-2-4-6-10(13)11(14)7-8-12(15)16-9/h7-11,13-14H,2-6H2,1H3/b8-7-/t9-,10-,11-/m1/s1
InChIKey PLHJPQNLCWFPFY-GOCSDFOFSA-N
SMILES O=C1O[C@@H](CCCCC[C@H]([C@@H](C=C1)O)O)C
Metabolite of Species Details
Cladosporium tenuissimum (NCBI:txid70808) See: DOI
ChEBI Ontology
Outgoing Cladospolide C (CHEBI:202912) is a macrolide (CHEBI:25106)
IUPAC Name
(3Z,5R,6R,12R)-5,6-dihydroxy-12-methyl-1-oxacyclododec-3-en-2-one
Manual Xref Database
13183223 ChemSpider
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