(Q27124851)

(1s,2R,3S,4r,5R,6S)-2,3,4,5,6-Pentahydroxycyclohexanaminium (English)

6 October 2016

chemical formula

C₆H₁₄NO₅⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C1(C(C(C(C(C1(O)[H])(O)[H])(O)[H])(O)[H])(O)[H])([NH3+])[H]

1 reference

1-ammonio-1-deoxy-scyllo-inositol (English)

6 October 2016

isomeric SMILES

[C@]1([C@@]([C@]([C@@]([C@]([C@@]1(O)[H])(O)[H])(O)[H])(O)[H])(O)[H])([NH3+])[H]

1 reference

1-ammonio-1-deoxy-scyllo-inositol (English)

InChI=1S/C6H13NO5/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6,8-12H,7H2/p+1/t1-,2-,3+,4+,5-,6-

6 October 2016

Identifiers

InChI

1 reference

1-ammonio-1-deoxy-scyllo-inositol (English)

JXAOTICXQLILTC-CDRYSYESSA-O

6 October 2016

InChIKey

2 references

1-ammonio-1-deoxy-scyllo-inositol (English)

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(1s,2R,3S,4r,5R,6S)-2,3,4,5,6-Pentahydroxycyclohexanaminium (English)

6 October 2016

1 reference

26 December 2021

mapping relation type

1 reference

1-ammonio-1-deoxy-scyllo-inositol (English)