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CHEBI:199611 - A32390A

ChEBI IDCHEBI:199611
ChEBI NameA32390A
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FormulaC18H28N2O8
Net Charge0
Average Mass400.428
Monoisotopic Mass400.18457
SMILESC=NC(C(=O)OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)COC(=O)C(N=C)=C(C)C)=C(C)C
InChIInChI=1S/C18H28N2O8/c1-9(2)13(19-5)17(25)27-7-11(21)15(23)16(24)12(22)8-28-18(26)14(20-6)10(3)4/h11-12,15-16,21-24H,5-8H2,1-4H3/t11-,12-,15-,16-/m1/s1
InChIKeyYNPCISSLHKFMKR-CZPYZCIJSA-N
Species of MetaboliteComponentSourceComments
Pyrenochaetaspecies (ncbitaxon:1755437) - PubMed (627520)
ChEBI Ontology
Outgoing Relation(s)
A32390A (CHEBI:199611) has functional parent α-amino acid (CHEBI:33704)
A32390A (CHEBI:199611) is a organonitrogen compound (CHEBI:35352)
A32390A (CHEBI:199611) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
[(2R,3R,4R,5R)-2,3,4,5-tetrahydroxy-6-[3-methyl-2-(methylideneamino)but-2-enoyl]oxyhexyl] 3-methyl-2-(methylideneamino)but-2-enoate
Manual XrefsDatabases
78439607ChemSpider