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CHEBI:224213 - Thiocladospolide B

ChEBI IDCHEBI:224213
ChEBI NameThiocladospolide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H24O7S
Net Charge0
Average Mass360.428
Monoisotopic Mass360.12427
SMILESCOC(=O)[C@H](O)CS[C@H]1CC(=O)C(=O)CCCCC[C@@H](C)OC1=O
InChIInChI=1S/C16H24O7S/c1-10-6-4-3-5-7-11(17)12(18)8-14(16(21)23-10)24-9-13(19)15(20)22-2/h10,13-14,19H,3-9H2,1-2H3/t10-,13-,14+/m1/s1
InChIKeyQVKWIAHHXHGDHB-HONMWMINSA-N
Species of MetaboliteComponentSourceComments
Cladosporium (ncbitaxon:5498) - PubMed (31038952)
ChEBI Ontology
Outgoing Relation(s)
Thiocladospolide B (CHEBI:224213) is a macrolide (CHEBI:25106)
IUPAC Name 
methyl (2S)-2-hydroxy-3-[[(3S,12R)-12-methyl-2,5,6-trioxo-oxacyclododec-3-yl]sulanyl]propanoate
Manual XrefsDatabases
76712511ChemSpider