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CHEBI:57491 - staurosporinium

ChEBI IDCHEBI:57491
ChEBI Namestaurosporinium
Stars
DefinitionConjugate acid of staurosporine.
Last Modified28 October 2021
DownloadsMolfile
FormulaC28H27N4O3
Net Charge+1
Average Mass467.549
Monoisotopic Mass467.20777
SMILESC[NH2+][C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4
InChIInChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/p+1/t17-,20-,26-,28+/m1/s1
InChIKeyHKSZLNNOFSGOKW-FYTWVXJKSA-O
ChEBI Ontology
Outgoing Relation(s)
staurosporinium (CHEBI:57491) is a ammonium ion derivative (CHEBI:35274)
staurosporinium (CHEBI:57491) is conjugate acid of staurosporine (CHEBI:15738)
Incoming Relation(s)
staurosporine (CHEBI:15738) is conjugate base of staurosporinium (CHEBI:57491)
IUPAC Name 
(5S,6R,7R,9R)-6-methoxy-N,5-dimethyl-14-oxo-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-7-aminium
Synonyms  Source
staurosporinium cationChEBI
(5S,6R,7R,9R)-6-methoxy-5-methyl-7-methylazaniumyl-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-14-oneChEBI
UniProt Name  Source
staurosporineUniProt
Manual XrefsDatabases
STAUROSPORINEMetaCyc