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CHEBI:222478 - Elloramycin E

ChEBI IDCHEBI:222478
ChEBI NameElloramycin E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H34O15
Net Charge0
Average Mass658.609
Monoisotopic Mass658.18977
SMILESCOC(=O)c1c(O[C@@H]2O[C@@H](C)[C@H](OC)[C@@H](OC)[C@@H]2OC)cc2cc3c(c(O)c2c1C)C(=O)[C@]1(OC)C(=O)C=C(OC)C(=O)[C@]1(O)C3=O
InChIInChI=1S/C32H34O15/c1-12-19-14(10-16(20(12)29(38)44-7)47-30-25(43-6)24(42-5)23(41-4)13(2)46-30)9-15-21(22(19)34)28(37)32(45-8)18(33)11-17(40-3)27(36)31(32,39)26(15)35/h9-11,13,23-25,30,34,39H,1-8H3/t13-,23-,24+,25-,30-,31+,32+/m0/s1
InChIKeyMJSZOVKYEBNDOP-XOFLNJHASA-N
Species of MetaboliteComponentSourceComments
Streptomyces olivaceus (ncbitaxon:47716) - PubMed (3755429)
ChEBI Ontology
Outgoing Relation(s)
Elloramycin E (CHEBI:222478) is a quinone (CHEBI:36141)
Elloramycin E (CHEBI:222478) is a tetracenes (CHEBI:51270)
IUPAC Name 
methyl (6aR,10aR)-6a,12-dihydroxy-8,10a-dimethoxy-1-methyl-6,7,10,11-tetraoxo-3-[(2S,3S,4R,5S,6S)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxytetracene-2-carboxylate
Manual XrefsDatabases
78443015ChemSpider