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CHEBI:210882 - Aspertoryadin G

ChEBI IDCHEBI:210882
ChEBI NameAspertoryadin G
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H23N3O6
Net Charge0
Average Mass461.474
Monoisotopic Mass461.15869
SMILESCC(=O)OC(c1nc2ccccc2c(=O)n1[C@@H]1C[C@]2(OC1=O)C(=O)Nc1ccccc12)C(C)C
InChIInChI=1S/C25H23N3O6/c1-13(2)20(33-14(3)29)21-26-17-10-6-4-8-15(17)22(30)28(21)19-12-25(34-23(19)31)16-9-5-7-11-18(16)27-24(25)32/h4-11,13,19-20H,12H2,1-3H3,(H,27,32)/t19-,20?,25-/m1/s1
InChIKeyAZCKWLNGUCCODX-HZSTXLHUSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (31823605)
ChEBI Ontology
Outgoing Relation(s)
Aspertoryadin G (CHEBI:210882) is a α-amino acid ester (CHEBI:46874)
IUPAC Name 
[1-[3-[(3R,3'R)-2,2'-dioxospiro[1H-indole-3,5'-oxolane]-3'-yl]-4-oxoquinazolin-2-yl]-2-methylpropyl] acetate
Manual XrefsDatabases
81360856ChemSpider