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CHEBI:215982 - Asperochramide D

ChEBI IDCHEBI:215982
ChEBI NameAsperochramide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H17N3O4
Net Charge0
Average Mass315.329
Monoisotopic Mass315.12191
SMILESO=C1N[C@@H](C[C@]2(O)C(=O)Nc3ccccc32)C(=O)N2CCC[C@@H]12
InChIInChI=1S/C16H17N3O4/c20-13-12-6-3-7-19(12)14(21)11(17-13)8-16(23)9-4-1-2-5-10(9)18-15(16)22/h1-2,4-5,11-12,23H,3,6-8H2,(H,17,20)(H,18,22)/t11-,12-,16+/m0/s1
InChIKeyMRTODJRLEATFDX-MQIPJXDCSA-N
Species of MetaboliteComponentSourceComments
Aspergillus ochraceus (ncbitaxon:40380) - PubMed (29479805)
ChEBI Ontology
Outgoing Relation(s)
Asperochramide D (CHEBI:215982) has functional parent α-amino acid (CHEBI:33704)
Asperochramide D (CHEBI:215982) is a organonitrogen compound (CHEBI:35352)
Asperochramide D (CHEBI:215982) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(3S,8aS)-3-[[(3R)-3-hydroxy-2-oxo-1H-indol-3-yl]methyl]-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione