CHEBI:197730 - Irlactin E

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ChEBI Name Irlactin E
ChEBI ID CHEBI:197730
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H22O3
Net Charge 0
Average Mass 250.338
Monoisotopic Mass 250.15689
InChI InChI=1S/C15H22O3/c1-8-10-5-15(2,3)6-11(10)12(7-16)9-4-13(8)18-14(9)17/h7-10,13-14,17H,4-6H2,1-3H3/t8-,9+,10+,13-,14-/m0/s1
InChIKey JTDLKHLQSBHHRH-IUWMTURJSA-N
SMILES O=CC1=C2[C@@H]([C@H](C)[C@@H]3C[C@H]1[C@H](O3)O)CC(C2)(C)C
Metabolite of Species Details
Irpex lacteus (NCBI:txid5319) See: DOI
ChEBI Ontology
Outgoing Irlactin E (CHEBI:197730) is a oxolanes (CHEBI:26912)
IUPAC Name
(1R,7R,8S,9S,11S)-11-hydroxy-5,5,8-trimethyl-10-oxatricyclo[7.2.1.03,7]dodec-2-ene-2-carbaldehyde