CHEBI:218302 - Sporidesmin E

ChEBI IDCHEBI:218302
ChEBI NameSporidesmin E
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SubmitterMetaboLights
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FormulaC18H20ClN3O6S3
Net Charge0
Average Mass506.027
Monoisotopic Mass505.02028
SMILESCOc1c(Cl)cc2c(c1OC)N(C)C1N3C(=O)C4(C)SSSC3(C(=O)N4C)C(O)C21O
InChIInChI=1S/C18H20ClN3O6S3/c1-16-14(24)22-13-17(26,12(23)18(22,30-31-29-16)15(25)21(16)3)7-6-8(19)10(27-4)11(28-5)9(7)20(13)2/h6,12-13,23,26H,1-5H3
InChIKeyNAEONKBZNXPTMI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pithomyces chartarum (ncbitaxon:1547544) - DOI (10.1039/j39690001665)
ChEBI Ontology
Outgoing Relation(s)
Sporidesmin E (CHEBI:218302) is a pyrroloindole (CHEBI:48133)
IUPAC Name 
6-chloro-2,3-dihydroxy-7,8-dimethoxy-10,14,19-trimethyl-15,16,17-trithia-10,12,19-triazapentacyclo[12.3.2.01,12.03,11.04,9]nonadeca-4,6,8-triene-13,18-dione
Manual XrefsDatabases
2341441ChemSpider