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CHEBI:221402 - Tryptoquivaline P

ChEBI IDCHEBI:221402
ChEBI NameTryptoquivaline P
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H24N4O5
Net Charge0
Average Mass448.479
Monoisotopic Mass448.17467
SMILESCOC(=O)C(C[C@]1(O)c2ccccc2N2C(=O)C(C)(C)N[C@H]21)n1cnc2ccccc2c1=O
InChIInChI=1S/C24H24N4O5/c1-23(2)22(31)28-17-11-7-5-9-15(17)24(32,21(28)26-23)12-18(20(30)33-3)27-13-25-16-10-6-4-8-14(16)19(27)29/h4-11,13,18,21,26,32H,12H2,1-3H3/t18?,21-,24+/m1/s1
InChIKeyYXSZOHZDGZIRMS-UJJNXARTSA-N
Species of MetaboliteComponentSourceComments
Neosartorya (ncbitaxon:36629) - PubMed (23088499)
ChEBI Ontology
Outgoing Relation(s)
Tryptoquivaline P (CHEBI:221402) is a α-amino acid ester (CHEBI:46874)
IUPAC Name 
methyl 3-[(3aR,4S)-4-hydroxy-2,2-dimethyl-1-oxo-3,3a-dihydroimidazo[1,2-a]indol-4-yl]-2-(4-oxoquinazolin-3-yl)propanoate
Manual XrefsDatabases
78441191ChemSpider