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CHEBI:188528 - gymnastatin N

ChEBI IDCHEBI:188528
ChEBI Namegymnastatin N
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H33NO4
Net Charge0
Average Mass387.520
Monoisotopic Mass387.24096
SMILESCCCCCC[C@@H](C)/C=C(C)/C=C/C(=O)NC(Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C23H33NO4/c1-4-5-6-7-8-17(2)15-18(3)9-14-22(26)24-21(23(27)28)16-19-10-12-20(25)13-11-19/h9-15,17,21,25H,4-8,16H2,1-3H3,(H,24,26)(H,27,28)/b14-9+,18-15+/t17-,21?/m1/s1
InChIKeyTVFBRUKGDMJDMC-AYCBYQTHSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
gymnastatin N (CHEBI:188528) is a tyrosine derivative (CHEBI:62761)
IUPAC Name 
2-[[(2E,4E,6R)-4,6-dimethyldodeca-2,4-dienoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
Manual XrefsDatabases
9626878ChemSpider