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CHEBI:182097 - 4-(2-Nitroethyl)phenyl primeveroside

ChEBI IDCHEBI:182097
ChEBI Name4-(2-Nitroethyl)phenyl primeveroside
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FormulaC19H27NO12
Net Charge0
Average Mass461.420
Monoisotopic Mass461.15333
SMILESO=[N+]([O-])CCc1ccc(OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)cc1
InChIInChI=1S/C19H27NO12/c21-11-7-29-18(16(25)13(11)22)30-8-12-14(23)15(24)17(26)19(32-12)31-10-3-1-9(2-4-10)5-6-20(27)28/h1-4,11-19,21-26H,5-8H2
InChIKeyZHVLPKFAODFQST-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(2-Nitroethyl)phenyl primeveroside (CHEBI:182097) is a glycoside (CHEBI:24400)
IUPAC Name 
2-[4-(2-nitroethyl)phenoxy]-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol
Manual XrefsDatabases
HMDB0031742HMDB