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CHEBI:188038 - Anatoxin a(s)

ChEBI IDCHEBI:188038
ChEBI NameAnatoxin a(s)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H17N4O4P
Net Charge0
Average Mass252.211
Monoisotopic Mass252.09874
SMILESCOP(=O)(O)ON1C(N)=NC[C@@H]1CN(C)C
InChIInChI=1S/C7H17N4O4P/c1-10(2)5-6-4-9-7(8)11(6)15-16(12,13)14-3/h6H,4-5H2,1-3H3,(H2,8,9)(H,12,13)/t6-/m1/s1
InChIKeyFYXHGVMFJYHPFX-ZCFIWIBFSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
ChEBI Ontology
Outgoing Relation(s)
Anatoxin a(s) (CHEBI:188038) is a monoalkyl phosphate (CHEBI:25381)
IUPAC Name 
[(5S)-2-amino-5-[(dimethylamino)methyl]-4,5-dihydroimidazol-1-yl] methyl hydrogen phosphate
Manual XrefsDatabases
102921ChemSpider
C19998KEGG COMPOUND
Registry NumbersSources
CAS:103170-78-1ChemIDplus