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CHEBI:131930 - validamine 7-phosphate

ChEBI IDCHEBI:131930
ChEBI Namevalidamine 7-phosphate
Stars
DefinitionA cyclitol phosphate that is validamine carrying a single monophosphate substituent at position 7.
Last Modified17 May 2016
SubmitterSteve
DownloadsMolfile
FormulaC7H16NO7P
Net Charge0
Average Mass257.179
Monoisotopic Mass257.06644
SMILESN[C@H]1C[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C7H16NO7P/c8-4-1-3(2-15-16(12,13)14)5(9)7(11)6(4)10/h3-7,9-11H,1-2,8H2,(H2,12,13,14)/t3-,4+,5-,6+,7+/m1/s1
InChIKeyWTRFKFAOQHUCRP-UOYQFSTFSA-N
ChEBI Ontology
Outgoing Relation(s)
validamine 7-phosphate (CHEBI:131930) has functional parent validamine (CHEBI:30449)
validamine 7-phosphate (CHEBI:131930) is a amino cyclitol (CHEBI:61689)
validamine 7-phosphate (CHEBI:131930) is a cyclitol phosphate (CHEBI:23450)
validamine 7-phosphate (CHEBI:131930) is conjugate acid of validamine 7-phosphate(1−) (CHEBI:111503)
Incoming Relation(s)
validamine 7-phosphate(1−) (CHEBI:111503) is conjugate base of validamine 7-phosphate (CHEBI:131930)
IUPAC Name 
[(1R,2R,3S,4S,5S)-5-amino-2,3,4-trihydroxycyclohexyl]methyl dihydrogen phosphate
Manual XrefsDatabases
CPD-18788MetaCyc
Registry NumbersSources
Reaxys:23007826Reaxys
Citations