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CHEBI:132734 - 6-methylpretetramide(1−)

Default Structure
ChEBI IDCHEBI:132734
ChEBI Name6-methylpretetramide(1−)
Stars
ASCII Name6-methylpretetramide(1-)
DefinitionA phenolate anion that is the conjugate base of 6-methylpretetramide, obtained by deprotonation of the 1-hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Last Modified23 November 2016
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H14NO6
Net Charge-1
Average Mass364.333
Monoisotopic Mass364.08266
SMILESCc1c2cccc(O)c2c(O)c2c(O)c3c([O-])c(C(N)=O)c(O)cc3cc12
InChIInChI=1S/C20H15NO6/c1-7-9-3-2-4-11(22)14(9)19(26)15-10(7)5-8-6-12(23)16(20(21)27)18(25)13(8)17(15)24/h2-6,22-26H,1H3,(H2,21,27)/p-1
InChIKeyWBDQDVXPSGTJAV-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
6-methylpretetramide(1−) (CHEBI:132734) is a phenolate anion (CHEBI:50525)
6-methylpretetramide(1−) (CHEBI:132734) is conjugate base of 6-methylpretetramide (CHEBI:27879)
Incoming Relation(s)
6-methylpretetramide (CHEBI:27879) is conjugate acid of 6-methylpretetramide(1−) (CHEBI:132734)
IUPAC Name 
2-carbamoyl-3,10,11,12-tetrahydroxy-6-methyltetracen-1-olate
Synonym  Source
6-methylpretetramid(1−)ChEBI
UniProt Name  Source
6-methylpretetramideUniProt
Manual XrefsDatabases
CPD-19273MetaCyc
Citations