CHEBI:202089 - Chaetomugilin L

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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 Chaetomugilin L
ChEBI ID CHEBI:202089
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H29ClO4
Net Charge 0
Average Mass 404.930
Monoisotopic Mass 404.17544
InChI InChI=1S/C23H29ClO4/c1-7-14(3)9-10-16-11-17-18(13-27-16)19-12-23(26-6,15(4)8-2)28-22(19,5)21(25)20(17)24/h8-11,13-14,19H,7,12H2,1-6H3/b10-9+,15-8+/t14-,19-,22-,23-/m0/s1
InChIKey KFQCGBJJOYTCQU-SISWDXRISA-N
SMILES ClC1=C2C(=COC(=C2)/C=C/[C@H](CC)C)[C@@H]3C[C@@](O[C@@]3(C1=O)C)(OC)/C(=C/C)/C
Metabolite of Species Details
Chaetomium globosum (NCBI:txid38033) See: DOI
ChEBI Ontology
Outgoing Chaetomugilin L (CHEBI:202089) is a ketal (CHEBI:59777)
IUPAC Name
(6aS,8S,9aS)-8-[(E)-but-2-en-2-yl]-5-chloro-8-methoxy-6a-methyl-3-[(E,3S)-3-methylpent-1-enyl]-9,9a-dihydrouro[2,3-h]isochromen-6-one
Manual Xref Database
27024229 ChemSpider
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