CHEBI:202019 - 7-Chloro-1-O-methyl-w-hydroxyemodin

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ChEBI Name 7-Chloro-1-O-methyl-w-hydroxyemodin
ChEBI ID CHEBI:202019
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H11ClO6
Net Charge 0
Average Mass 334.710
Monoisotopic Mass 334.02442
InChI InChI=1S/C16H11ClO6/c1-23-10-3-6(5-18)2-7-11(10)15(21)12-8(14(7)20)4-9(19)13(17)16(12)22/h2-4,18-19,22H,5H2,1H3
InChIKey LAWIYIBDGDHAKG-UHFFFAOYSA-N
SMILES ClC1=C(O)C=2C(=O)C3=C(OC)C=C(CO)C=C3C(C2C=C1O)=O
Metabolite of Species Details
Nephroma laevigatum (NCBI:txid203386) See: DOI
ChEBI Ontology
Outgoing 7-Chloro-1-O-methyl-w-hydroxyemodin (CHEBI:202019) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name
2-chloro-1,3-dihydroxy-6-(hydroxymethyl)-8-methoxyanthracene-9,10-dione
Manual Xref Database
78435941 ChemSpider
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