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CHEBI:61284 - scutellarin(1−)

ChEBI IDCHEBI:61284
ChEBI Namescutellarin(1−)
Stars
ASCII Namescutellarin(1-)
DefinitionA monocarboxylic acid anion resulting from the deprotonation of the carboxy group of scutellarin.
Last Modified11 January 2012
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC21H17O12
Net Charge-1
Average Mass461.355
Monoisotopic Mass461.07255
SMILESO=C([O-])[C@H]1O[C@@H](Oc2cc3oc(-c4ccc(O)cc4)cc(=O)c3c(O)c2O)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C21H18O12/c22-8-3-1-7(2-4-8)10-5-9(23)13-11(31-10)6-12(14(24)15(13)25)32-21-18(28)16(26)17(27)19(33-21)20(29)30/h1-6,16-19,21-22,24-28H,(H,29,30)/p-1/t16-,17-,18+,19-,21+/m0/s1
InChIKeyDJSISFGPUUYILV-ZFORQUDYSA-M
ChEBI Ontology
Outgoing Relation(s)
scutellarin(1−) (CHEBI:61284) is a carbohydrate acid derivative anion (CHEBI:63551)
scutellarin(1−) (CHEBI:61284) is a monocarboxylic acid anion (CHEBI:35757)
scutellarin(1−) (CHEBI:61284) is conjugate base of scutellarin (CHEBI:61278)
Incoming Relation(s)
scutellarin (CHEBI:61278) is conjugate acid of scutellarin(1−) (CHEBI:61284)
IUPAC Name 
5,6-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl β-D-glucopyranosiduronate
Synonym  Source
scutellarein 7-O-β-D-glucuronateChEBI
UniProt Name  Source
scutellarinUniProt
Citations