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CHEBI:210066 - 2'-O-L-quinovosyl saphenate

ChEBI IDCHEBI:210066
ChEBI Name2'-O-L-quinovosyl saphenate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22N2O7
Net Charge0
Average Mass414.414
Monoisotopic Mass414.14270
SMILESCC(O)c1cccc2nc3c(C(=O)O[C@H]4[C@H](O)[C@@H](O)[C@H](C)O[C@@H]4O)cccc3nc12
InChIInChI=1S/C21H22N2O7/c1-9(24)11-5-3-7-13-15(11)22-14-8-4-6-12(16(14)23-13)20(27)30-19-18(26)17(25)10(2)29-21(19)28/h3-10,17-19,21,24-26,28H,1-2H3/t9?,10-,17-,18+,19-,21-/m0/s1
InChIKeyOZPGCLJPZPDKKZ-XNZNGCIUSA-N
ChEBI Ontology
Outgoing Relation(s)
2'-O-L-quinovosyl saphenate (CHEBI:210066) is a phenazines (CHEBI:39201)
IUPAC Name 
[(2S,3S,4R,5R,6S)-2,4,5-trihydroxy-6-methyloxan-3-yl] 6-(1-hydroxyethyl)phenazine-1-carboxylate
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