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CHEBI:205101 - Cristatumin D

ChEBI IDCHEBI:205101
ChEBI NameCristatumin D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H21N3O4
Net Charge0
Average Mass355.394
Monoisotopic Mass355.15321
SMILESC=CC(C)(C)c1nc2ccccc2c1/C=C(\NC(=O)C(N)=O)C(=O)OC
InChIInChI=1S/C19H21N3O4/c1-5-19(2,3)15-12(11-8-6-7-9-13(11)21-15)10-14(18(25)26-4)22-17(24)16(20)23/h5-10,21H,1H2,2-4H3,(H2,20,23)(H,22,24)/b14-10-
InChIKeyWMAYXXXLOKRQKS-UVTDQMKNSA-N
Species of MetaboliteComponentSourceComments
Eurotium (ncbitaxon:28569) - PubMed (22727636)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Cristatumin D (CHEBI:205101) is a peptide (CHEBI:16670)
IUPAC Name 
methyl (Z)-3-[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]-2-(oxamoylamino)prop-2-enoate
Manual XrefsDatabases
28505170ChemSpider