1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol (Q27104832)

(2R)-2,3-Dihydroxypropyl (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl phosphate (English)

5 October 2016

chemical formula

C₉H₁₈O₁₁P⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C(C(COP([O-])(=O)OC1(C(C(C(C(C1(O)[H])(O)[H])(O)[H])(O)[H])(O)[H])[H])(O)[H])O

1 reference

1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol (English)

5 October 2016

isomeric SMILES

C([C@](COP([O-])(=O)O[C@@]1([C@@]([C@@]([C@]([C@@]([C@]1(O)[H])(O)[H])(O)[H])(O)[H])(O)[H])[H])(O)[H])O

1 reference

https://reactome.org/PathwayBrowser/#/R-HSA-1430728&DTAB=MT

1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol (English)

5 October 2016

1 reference

Identifiers

InChI

InChI=1S/C9H19O11P/c10-1-3(11)2-19-21(17,18)20-9-7(15)5(13)4(12)6(14)8(9)16/h3-16H,1-2H2,(H,17,18)/p-1/t3-,4-,5-,6+,7-,8-,9-/m1/s1

1 reference

1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol (English)

BMVUIWJCUQSHLZ-UJGXJMNGSA-M

5 October 2016

InChIKey

2 references

1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol (English)

5 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(2R)-2,3-Dihydroxypropyl (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl phosphate (English)

5 October 2016

ChEBI ID

58444

mapping relation type

2 references

1-(sn-glycero-3-O-phosphonato)-1D-myo-inositol (English)