(2R,5R)-2-(6-amino-2-fluoro-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol (Q27166195)

SCHEMBL3655059 (English)

9 October 2016

chemical formula

C₁₀H₁₂FN₅O₄

1 reference

SCHEMBL3655059 (English)

9 October 2016

canonical SMILES

C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=C(N=C2N)F

1 reference

SCHEMBL3655059 (English)

9 October 2016

isomeric SMILES

C1=NC2=C(N1[C@H]3C(C([C@H](O3)CO)O)O)N=C(N=C2N)F

1 reference

SCHEMBL3655059 (English)

InChI=1S/C10H12FN5O4/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,14,15)/t3-,5?,6?,9-/m1/s1

9 October 2016

Identifiers

InChI

1 reference

SCHEMBL3655059 (English)

HBUBKKRHXORPQB-VKJDSPIKSA-N

9 October 2016

InChIKey

2 references

SCHEMBL3655059 (English)

9 October 2016

stated in

ChEBI release 2020-09-01

2 references

SCHEMBL3655059 (English)

matched by identifier from

9 October 2016

InChIKey

HBUBKKRHXORPQB-VKJDSPIKSA-N

ChEBI ID

94359

mapping relation type

2 references

(2R,5R)-2-(6-amino-2-fluoro-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol (English)