CHEBI:208162 - Illudin 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 Illudin I
ChEBI ID CHEBI:208162
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/c1-9-12(17)10-6-13(2,8-16)7-11(10)14(3,18)15(9)4-5-15/h9,16,18H,4-8H2,1-3H3/t9-,13-,14+/m0/s1
InChIKey YGFFPRMOBZCYOE-QCZZGDTMSA-N
SMILES O=C1C2=C([C@](O)(C)C3([C@H]1C)CC3)C[C@](C2)(CO)C
Metabolite of Species Details
Coprinopsis episcopalis (NCBI:txid210012) See: PubMed
ChEBI Ontology
Outgoing Illudin I (CHEBI:208162) is a cyclohexenones (CHEBI:48953)
IUPAC Name
(2R,5R,7S)-7-hydroxy-2-(hydroxymethyl)-2,5,7-trimethylspiro[3,5-dihydro-1H-indene-6,1'-cyclopropane]-4-one
Manual Xref Database
78440461 ChemSpider
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