CHEBI:219785 - Scytalidin

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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 Scytalidin
ChEBI ID CHEBI:219785
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information ZINC000004097885
Download Molfile XML SDF
Formula C22H28O7
Net Charge 0
Average Mass 404.459
Monoisotopic Mass 404.18350
InChI InChI=1S/C22H28O7/c1-3-5-7-8-13-10-14-15(19(24)28-18(14)23)11-22(27,9-6-4-2)12-16-17(13)21(26)29-20(16)25/h13,27H,3-12H2,1-2H3
InChIKey FLCKGELADIJEEM-UHFFFAOYSA-N
SMILES O=C1OC(=O)C2=C1C(CC=3C(=O)OC(C3CC(C2)(O)CCCC)=O)CCCCC
Metabolite of Species Details
Scytalidiumspecies (NCBI:txid1715249) See: PubMed
ChEBI Ontology
Outgoing Scytalidin (CHEBI:219785) has functional parent tetracarboxylic acid (CHEBI:35742)
Scytalidin (CHEBI:219785) is a organooxygen compound (CHEBI:36963)
IUPAC Name
10-butyl-10-hydroxy-2-pentyl-6,14-dioxatricyclo[10.3.0.04,8]pentadeca-1(12),4(8)-diene-5,7,13,15-tetrone
Manual Xref Database
278647 ChemSpider
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