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CHEBI:28399 - 1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol 6-phosphate

ChEBI IDCHEBI:28399
ChEBI Name1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol 6-phosphate
Stars
ASCII Name1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol 6-phosphate
DefinitionA scyllo-inositol phosphate that is 1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol carrying a single phospho substituent at position 6.
Secondary ChEBI IDsCHEBI:806, CHEBI:19182
Last Modified9 May 2017
DownloadsMolfile
FormulaC7H17N4O7P
Net Charge0
Average Mass300.208
Monoisotopic Mass300.08349
SMILESN=C(N)N[C@@H]1[C@@H](O)[C@H](N)[C@@H](O)[C@H](O)[C@H]1OP(=O)(O)O
InChIInChI=1S/C7H17N4O7P/c8-1-3(12)2(11-7(9)10)6(5(14)4(1)13)18-19(15,16)17/h1-6,12-14H,8H2,(H4,9,10,11)(H2,15,16,17)/t1-,2+,3-,4+,5-,6-/m0/s1
InChIKeyYFFQDNQRUIYSNO-FUHDGFEASA-N
ChEBI Ontology
Outgoing Relation(s)
1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol 6-phosphate (CHEBI:28399) has functional parent scyllo-inositol (CHEBI:10642)
1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol 6-phosphate (CHEBI:28399) is a scyllo-inositol phosphate (CHEBI:26613)
1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol 6-phosphate (CHEBI:28399) is tautomer of 1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol 6-phosphate dizwitterion (CHEBI:134496)
Incoming Relation(s)
1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol 6-phosphate dizwitterion (CHEBI:134496) is tautomer of 1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol 6-phosphate (CHEBI:28399)
IUPAC Names 
(1S,2R,3S,4S,5R,6S)-4-amino-2-carbamimidamido-3,5,6-trihydroxycyclohexyl dihydrogen phosphate
1D-3-amino-1-carbamimidamido-1,3-dideoxy-scyllo-inositol 6-(dihydrogen phosphate)
Synonyms  Source
1D-1-Guanidino-3-amino-1,3-dideoxy-scyllo-inositol 6-phosphateKEGG COMPOUND
1D-1-Guanidino-3-amino-1,3-dideoxy-scyllo-inositol 6-phosphateKEGG COMPOUND
Manual XrefsDatabases
C11351KEGG COMPOUND