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CHEBI:83856 - dalpatein(1−)

ChEBI IDCHEBI:83856
ChEBI Namedalpatein(1−)
Stars
ASCII Namedalpatein(1-)
DefinitionA flavonoid oxoanion that is the conjugate base of dalpatein, obtained by deprotonation of the 7-hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Last Modified6 February 2015
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC18H13O7
Net Charge-1
Average Mass341.295
Monoisotopic Mass341.06668
SMILESCOc1cc2c(=O)c(-c3cc4c(cc3OC)OCO4)coc2cc1[O-]
InChIInChI=1S/C18H14O7/c1-21-13-6-17-16(24-8-25-17)3-9(13)11-7-23-14-5-12(19)15(22-2)4-10(14)18(11)20/h3-7,19H,8H2,1-2H3/p-1
InChIKeyGYUPEJCNVAKZSU-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
dalpatein(1−) (CHEBI:83856) is a flavonoid oxoanion (CHEBI:60038)
dalpatein(1−) (CHEBI:83856) is conjugate base of dalpatein (CHEBI:55549)
Incoming Relation(s)
dalpatein (CHEBI:55549) is conjugate acid of dalpatein(1−) (CHEBI:83856)
IUPAC Name 
6-methoxy-3-(6-methoxy-1,3-benzodioxol-5-yl)-4-oxo-4H-chromen-7-olate
UniProt Name  Source
dalpateinUniProt