CHEBI:228032 - Spiromastilactone L

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ChEBI Name Spiromastilactone L
ChEBI ID CHEBI:228032
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H18Cl4O6
Net Charge 0
Average Mass 496.160
Monoisotopic Mass 493.98575
InChI InChI=1S/C20H18Cl4O6/c1-4-6-7-11(21)15(25)14(24)19(28-3)17(7)30-18-10-9(8(5-2)29-20(10)27)12(22)16(26)13(18)23/h8,25-26H,4-6H2,1-3H3/t8-/m1/s1
InChIKey QVPYNVLZTLIESF-MRVPVSSYSA-N
SMILES ClC1=C(OC)C(OC2=C(Cl)C(O)=C(Cl)C3=C2C(=O)O[C@@H]3CC)=C(CCC)C(=C1O)Cl
Metabolite of Species Details
Spiromastixspecies (NCBI:txid2044277) See: PubMed
ChEBI Ontology
Outgoing Spiromastilactone L (CHEBI:228032) is a aromatic ether (CHEBI:35618)
IUPAC Name
(3R)-4,6-dichloro-7-(3,5-dichloro-4-hydroxy-2-methoxy-6-propylphenoxy)-3-ethyl-5-hydroxy-3H-2-benzouran-1-one
Manual Xref Database
58197290 ChemSpider
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