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CHEBI:70403 - citrinalin A

ChEBI IDCHEBI:70403
ChEBI Namecitrinalin A
Stars
DefinitionA natural product found in Penicillium citrinum.
Last Modified22 September 2014
DownloadsMolfile
FormulaC25H32N3O5
Net Charge+1
Average Mass454.547
Monoisotopic Mass454.23365
SMILES[H][C@@]12CCC[NH+]1C[C@]1([N+](=O)[O-])C[C@]3(C(=O)Nc4c3ccc3c4C(=O)CC(C)(C)O3)C(C)(C)[C@@]1([H])C2
InChIInChI=1S/C25H31N3O5/c1-22(2)11-16(29)19-17(33-22)8-7-15-20(19)26-21(30)25(15)12-24(28(31)32)13-27-9-5-6-14(27)10-18(24)23(25,3)4/h7-8,14,18H,5-6,9-13H2,1-4H3,(H,26,30)/p+1/t14-,18+,24+,25-/m0/s1
InChIKeyQVBARITWSQCBBV-DTKOROOESA-O
Species of MetaboliteComponentSourceComments
Penicillium citrinum (ncbitaxon:5077) - PubMed (21053938) Penicillium species isolated from a seaweed caulerpa sp. Strain: F53
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
citrinalin A (CHEBI:70403) has functional parent δ-amino acid (CHEBI:35931)
citrinalin A (CHEBI:70403) has role metabolite (CHEBI:25212)
citrinalin A (CHEBI:70403) is a organonitrogen compound (CHEBI:35352)
citrinalin A (CHEBI:70403) is a organooxygen compound (CHEBI:36963)
Citations