5-formimidoyltetrahydrofolate(2-) (Q27124702)

inferred from isomeric SMILES

1 February 2021

mass

470.1673275838199 dalton

1 reference

based on heuristic

conjugate acid

5-formimidoyltetrahydrofolic acid

0 references

chemical formula

C₂₀H₂₂N₈O₆²⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C1C(N(C2=C(N1)NC(=NC2=O)N)C=N)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)[O-])C(=O)[O-]

1 reference

5-formimidoyltetrahydrofolate (English)

6 October 2016

isomeric SMILES

C1[C@@H](N(C2=C(N1)NC(=NC2=O)N)C=N)CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-]

1 reference

5-formimidoyltetrahydrofolate (English)

InChI=1S/C20H24N8O6/c21-9-28-12(8-24-16-15(28)18(32)27-20(22)26-16)7-23-11-3-1-10(2-4-11)17(31)25-13(19(33)34)5-6-14(29)30/h1-4,9,12-13,21,23H,5-8H2,(H,25,31)(H,29,30)(H,33,34)(H4,22,24,26,27,32)/p-2/t12-,13-/m0/s1

6 October 2016

Identifiers

InChI

1 reference

5-formimidoyltetrahydrofolate (English)

YCWUVLPMLLBDCU-STQMWFEESA-L

6 October 2016

InChIKey

2 references

5-formimidoyltetrahydrofolate (English)

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(2S)-2-{[4-({[(6S)-2-Amino-5-(iminomethyl)-4-oxo-1,4,5,6,7,8-hexahydro-6-pteridinyl]methyl}amino)benzoyl]amino}pentanedioate (English)

6 October 2016

1 reference

5-formimidoyltetrahydrofolate (English)

6 October 2016

ChEBI ID

57456

mapping relation type

2 references

5-formimidoyltetrahydrofolate(2-) (English)