CHEBI:227270 - Tryptoquivaline F

ChEBI IDCHEBI:227270
ChEBI NameTryptoquivaline F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H18N4O4
Net Charge0
Average Mass402.410
Monoisotopic Mass402.13281
SMILESC[C@@H]1N[C@@H]2N(C1=O)c1ccccc1[C@@]21C[C@@H](n2cnc3ccccc3c2=O)C(=O)O1
InChIInChI=1S/C22H18N4O4/c1-12-18(27)26-16-9-5-3-7-14(16)22(21(26)24-12)10-17(20(29)30-22)25-11-23-15-8-4-2-6-13(15)19(25)28/h2-9,11-12,17,21,24H,10H2,1H3/t12-,17+,21+,22-/m0/s1
InChIKeyZVBIGFFAMBWOSA-RGKJGADRSA-N
Species of MetaboliteComponentSourceComments
Neosartorya (ncbitaxon:36629) - DOI (10.1016/j.tet.2012.02.024)
ChEBI Ontology
Outgoing Relation(s)
Tryptoquivaline F (CHEBI:227270) is a α-amino acid ester (CHEBI:46874)
IUPAC Name 
(2S,3'R,3aR,4S)-2-methyl-3'-(4-oxoquinazolin-3-yl)spiro[3,3a-dihydro-2H-imidazo[1,2-a]indole-4,5'-oxolane]-1,2'-dione
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