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CHEBI:199404 - Solphenazine E

ChEBI IDCHEBI:199404
ChEBI NameSolphenazine E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20N2O7
Net Charge0
Average Mass400.387
Monoisotopic Mass400.12705
SMILESCOC(=O)c1cccc2nc3c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cccc3nc12
InChIInChI=1S/C20H20N2O7/c1-9-16(23)17(24)18(25)20(28-9)29-13-8-4-7-12-15(13)22-11-6-3-5-10(14(11)21-12)19(26)27-2/h3-9,16-18,20,23-25H,1-2H3/t9-,16-,17+,18+,20-/m0/s1
InChIKeyDQMHWXICIWIMRA-WZHKTHIMSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (23317013)
ChEBI Ontology
Outgoing Relation(s)
Solphenazine E (CHEBI:199404) is a glycoside (CHEBI:24400)
IUPAC Name 
methyl 6-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyphenazine-1-carboxylate
Manual XrefsDatabases
29418675ChemSpider