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CHEBI:210137 - Maremycin E

ChEBI IDCHEBI:210137
ChEBI NameMaremycin E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H23N3O5S
Net Charge0
Average Mass453.520
Monoisotopic Mass453.13584
SMILESCSCc1nc2c(nc1=O)[C@@H](C)C1(C(=O)N(C)c3ccccc31)C1(O)CCC(C(=O)O)=C21
InChIInChI=1S/C23H23N3O5S/c1-11-17-18(24-14(10-32-3)19(27)25-17)16-12(20(28)29)8-9-22(16,31)23(11)13-6-4-5-7-15(13)26(2)21(23)30/h4-7,11,31H,8-10H2,1-3H3,(H,25,27)(H,28,29)/t11-,22?,23?/m1/s1
InChIKeyHFXOVDHQTGZBCE-UBOACVNXSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1002/1099-0690(200101)2001:2<261::aid-ejoc261>3.0.co;2-6)
ChEBI Ontology
Outgoing Relation(s)
Maremycin E (CHEBI:210137) is a indoles (CHEBI:24828)
IUPAC Name 
(5S)-6a-hydroxy-1',5-dimethyl-2-(methylsulanylmethyl)-2',3-dioxospiro[4,5,7,8-tetrahydrocyclopenta[]quinoxaline-6,3'-indole]-9-carboxylic acid
Manual XrefsDatabases
8822688ChemSpider