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CHEBI:145839 - norrubrofusarin(1−)

Default Structure
ChEBI IDCHEBI:145839
ChEBI Namenorrubrofusarin(1−)
Stars
ASCII Namenorrubrofusarin(1-)
DefinitionA phenolate anion obtained by deprotonation of the 5-hydroxy group of norrubrofusarin. It is the major microspecies at pH 7.3.
Last Modified22 January 2020
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC14H9O5
Net Charge-1
Average Mass257.221
Monoisotopic Mass257.04555
SMILESCc1cc(=O)c2c([O-])c3c(O)cc(O)cc3cc2o1
InChIInChI=1S/C14H10O5/c1-6-2-9(16)13-11(19-6)4-7-3-8(15)5-10(17)12(7)14(13)18/h2-5,15,17-18H,1H3/p-1
InChIKeyRVRLLYKHCMHGKV-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
norrubrofusarin(1−) (CHEBI:145839) is a phenolate anion (CHEBI:50525)
norrubrofusarin(1−) (CHEBI:145839) is conjugate base of norrubrofusarin (CHEBI:81264)
Incoming Relation(s)
norrubrofusarin (CHEBI:81264) is conjugate acid of norrubrofusarin(1−) (CHEBI:145839)
IUPAC Name 
6,8-dihydroxy-2-methyl-4-oxo-4H-benzo[g]chromen-5-olate
Synonym  Source
6,8-dihydroxy-2-methyl-4-oxo-4H-naphtho[2,3-b]pyran-5-olateIUPAC
UniProt Name  Source
norrubrofusarinUniProt
Citations