CHEBI:225486 - Gregatin F2

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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 Gregatin F2
ChEBI ID CHEBI:225486
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H24O5
Net Charge 0
Average Mass 296.363
Monoisotopic Mass 296.16237
InChI InChI=1S/C16H24O5/c1-5-8-12-13(15(19)20-4)14(18)16(3,21-12)10-7-6-9-11(2)17/h7,10-11,17H,5-6,8-9H2,1-4H3/b10-7+/t11-,16+/m0/s1
InChIKey IBWFNBAINSITIL-XIONYYCNSA-N
SMILES O=C1C(=C(CCC)O[C@@]1(/C=C/CC[C@@H](O)C)C)C(=O)OC
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: PubMed
ChEBI Ontology
Outgoing Gregatin F2 (CHEBI:225486) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name
methyl (5R)-5-[(E,5S)-5-hydroxyhex-1-enyl]-5-methyl-4-oxo-2-propyluran-3-carboxylate