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CHEBI:214206 - Echoside E

ChEBI IDCHEBI:214206
ChEBI NameEchoside E
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SubmitterMetaboLights
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FormulaC26H23NO9S
Net Charge0
Average Mass525.535
Monoisotopic Mass525.10935
SMILESCn1c(=O)sc2c(-c3ccccc3)c(O)c(O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)c(-c3ccccc3)c21
InChIInChI=1S/C26H23NO9S/c1-27-16-14(12-8-4-2-5-9-12)21(35-25-20(31)18(29)19(30)22(36-25)24(32)33)17(28)15(23(16)37-26(27)34)13-10-6-3-7-11-13/h2-11,18-20,22,25,28-31H,1H3,(H,32,33)/t18-,19-,20+,22-,25+/m0/s1
InChIKeyIHUHIFKVCBIAMM-QDSRYJPQSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies LZ35 (ncbitaxon:1245024) - PubMed (24507923)
ChEBI Ontology
Outgoing Relation(s)
Echoside E (CHEBI:214206) is a para-terphenyl (CHEBI:75874)
IUPAC Name 
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(6-hydroxy-3-methyl-2-oxo-4,7-diphenyl-1,3-benzothiazol-5-yl)oxy]oxane-2-carboxylic acid
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31141638ChemSpider