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CHEBI:217887 - 2-chloro-cladosporol D

ChEBI IDCHEBI:217887
ChEBI Name2-chloro-cladosporol D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H17ClO6
Net Charge0
Average Mass388.803
Monoisotopic Mass388.07137
SMILESO=C1CC[C@@H](c2ccc(O)c3c2C(=O)[C@@H](Cl)[C@H](O)[C@@H]3O)c2cccc(O)c21
InChIInChI=1S/C20H17ClO6/c21-17-18(25)15-10(5-7-13(24)16(15)19(26)20(17)27)8-4-6-12(23)14-9(8)2-1-3-11(14)22/h1-3,5,7-8,17,19-20,22,24,26-27H,4,6H2/t8-,17-,19-,20+/m1/s1
InChIKeySMPZKKLHFUFDQT-WNEFXCTCSA-N
Species of MetaboliteComponentSourceComments
Cladosporium (ncbitaxon:5498) - DOI (10.1016/j.tetlet.2018.03.082)
ChEBI Ontology
Outgoing Relation(s)
2-chloro-cladosporol D (CHEBI:217887) is a tetralins (CHEBI:36786)
IUPAC Name 
(2S,3R,4R)-2-chloro-3,4,5-trihydroxy-8-[(1S)-5-hydroxy-4-oxo-2,3-dihydro-1H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-one
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78439412ChemSpider