CHEBI:205323 - Acremine I

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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 Acremine I
ChEBI ID CHEBI:205323
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H16O5
Net Charge 0
Average Mass 240.255
Monoisotopic Mass 240.09977
InChI InChI=1S/C12H16O5/c1-11(2,15)10-8(16-10)5-4-6(13)12(3)9(17-12)7(5)14/h4,7-10,14-15H,1-3H3/t7-,8-,9-,10+,12+/m1/s1
InChIKey OUGZTEBDFKLHPZ-OMHSBUABSA-N
SMILES O=C1C=C([C@@H](O)[C@@H]2[C@]1(O2)C)[C@H]3O[C@@H]3C(O)(C)C
Metabolite of Species Details
Simplicillium lanosoniveum (NCBI:txid132112) See: DOI
ChEBI Ontology
Outgoing Acremine I (CHEBI:205323) is a cyclohexenones (CHEBI:48953)
IUPAC Name
(1R,5R,6R)-5-hydroxy-4-[(2R,3S)-3-(2-hydroxypropan-2-yl)oxiran-2-yl]-1-methyl-7-oxabicyclo[4.1.0]hept-3-en-2-one
Manual Xref Database
27445048 ChemSpider
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