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CHEBI:211189 - Leptosphin A

ChEBI IDCHEBI:211189
ChEBI NameLeptosphin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O2S
Net Charge0
Average Mass260.358
Monoisotopic Mass260.08710
SMILESCc1c2c(cc3scc(CO)c13)C(=O)CC[C@@H]2C
InChIInChI=1S/C15H16O2S/c1-8-3-4-12(17)11-5-13-15(9(2)14(8)11)10(6-16)7-18-13/h5,7-8,16H,3-4,6H2,1-2H3/t8-/m0/s1
InChIKeyRFOVZVUDHBZNBJ-QMMMGPOBSA-N
Species of MetaboliteComponentSourceComments
Leptosphaeria (ncbitaxon:5021) - PubMed (31226283)
ChEBI Ontology
Outgoing Relation(s)
Leptosphin A (CHEBI:211189) is a organic heterotricyclic compound (CHEBI:26979)
Leptosphin A (CHEBI:211189) is a organosulfur heterocyclic compound (CHEBI:38106)
IUPAC Name 
(5S)-3-(hydroxymethyl)-4,5-dimethyl-6,7-dihydro-5H-benzo[][1]benzothiol-8-one