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CHEBI:225583 - Solitumidine C

ChEBI IDCHEBI:225583
ChEBI NameSolitumidine C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H27N3O4
Net Charge0
Average Mass373.453
Monoisotopic Mass373.20016
SMILESC=CC(C)(C)[C@@]1(CCNC(=O)CC[C@H](N)C(=O)O)C(=O)Nc2ccccc21
InChIInChI=1S/C20H27N3O4/c1-4-19(2,3)20(13-7-5-6-8-15(13)23-18(20)27)11-12-22-16(24)10-9-14(21)17(25)26/h4-8,14H,1,9-12,21H2,2-3H3,(H,22,24)(H,23,27)(H,25,26)/t14-,20+/m0/s1
InChIKeyVYFMZWTUDHSVAL-VBKZILBWSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (31895573)
ChEBI Ontology
Outgoing Relation(s)
Solitumidine C (CHEBI:225583) is a glutamine derivative (CHEBI:70813)
IUPAC Name 
(2S)-2-amino-5-[2-[(3R)-3-(2-methylbut-3-en-2-yl)-2-oxo-1H-indol-3-yl]ethylamino]-5-oxopentanoic acid
Manual XrefsDatabases
81367086ChemSpider