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CHEBI:215388 - 6-hydroxymetatacarboline F

ChEBI IDCHEBI:215388
ChEBI Name6-hydroxymetatacarboline F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H28N4O7
Net Charge0
Average Mass496.520
Monoisotopic Mass496.19580
SMILESCC(C)[C@H](NC(=O)c1cc2c(nc3ccc(O)cc32)c(CCC(=O)N2CCC[C@H]2C(=O)O)n1)C(=O)O
InChIInChI=1S/C25H28N4O7/c1-12(2)21(25(35)36)28-23(32)18-11-15-14-10-13(30)5-6-16(14)27-22(15)17(26-18)7-8-20(31)29-9-3-4-19(29)24(33)34/h5-6,10-12,19,21,27,30H,3-4,7-9H2,1-2H3,(H,28,32)(H,33,34)(H,35,36)/t19-,21-/m0/s1
InChIKeyZWTPKAPMAMGDML-FPOVZHCZSA-N
Species of MetaboliteComponentSourceComments
Mycena metata (ncbitaxon:1033252) - PubMed (23330951)
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
6-hydroxymetatacarboline F (CHEBI:215388) is a harmala alkaloid (CHEBI:61379)
IUPAC Name 
(2S)-1-[3-[3-[[(1S)-1-carboxy-2-methylpropyl]carbamoyl]-6-hydroxy-9H-pyrido[3,4-b]indol-1-yl]propanoyl]pyrrolidine-2-carboxylic acid
Manual XrefsDatabases
78437540ChemSpider