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CHEBI:217836 - Rubrumline K

ChEBI IDCHEBI:217836
ChEBI NameRubrumline K
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SubmitterMetaboLights
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FormulaC20H23N3O4
Net Charge0
Average Mass369.421
Monoisotopic Mass369.16886
SMILESC=CC(C)(C)c1nc2ccccc2c1/C=C1\NC(=O)[C@@](CO)(OC)NC1=O
InChIInChI=1S/C20H23N3O4/c1-5-19(2,3)16-13(12-8-6-7-9-14(12)21-16)10-15-17(25)23-20(11-24,27-4)18(26)22-15/h5-10,21,24H,1,11H2,2-4H3,(H,22,26)(H,23,25)/b15-10-/t20-/m1/s1
InChIKeyVCCYZSJJWBGBNJ-CKOFDZGGSA-N
Species of MetaboliteComponentSourceComments
Aspergillus ruber (ncbitaxon:396024) - PubMed (25681711)
ChEBI Ontology
Outgoing Relation(s)
Rubrumline K (CHEBI:217836) has functional parent α-amino acid (CHEBI:33704)
Rubrumline K (CHEBI:217836) is a organonitrogen compound (CHEBI:35352)
Rubrumline K (CHEBI:217836) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(3R,6Z)-3-(hydroxymethyl)-3-methoxy-6-[[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]methylidene]piperazine-2,5-dione
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40256788ChemSpider