(Q27463208)

(2S,5R)-1-Formyl-N-(4-piperidinyl)-5-[(sulfooxy)amino]-2-piperidinecarboxamide (English)

19 October 2016

chemical formula

C₁₂H₂₂N₄O₆S

1 reference

stated in

RCSB protein data bank

PDB ligand ID

MK7

16 February 2021

canonical SMILES

C1CC(N(CC1NOS(=O)(=O)O)C=O)C(=O)NC2CCNCC2

1 reference

(2S,5R)-1-Formyl-N-(4-piperidinyl)-5-[(sulfooxy)amino]-2-piperidinecarboxamide (English)

19 October 2016

isomeric SMILES

C1C[C@H](N(C[C@@H]1NOS(=O)(=O)O)C=O)C(=O)NC2CCNCC2

1 reference

stated in

RCSB protein data bank

PDB ligand ID

MK7

InChI=1S/C12H22N4O6S/c17-8-16-7-10(15-22-23(19,20)21)1-2-11(16)12(18)14-9-3-5-13-6-4-9/h8-11,13,15H,1-7H2,(H,14,18)(H,19,20,21)/t10-,11+/m1/s1

16 February 2021

Identifiers

InChI

1 reference

(2S,5R)-1-Formyl-N-(4-piperidinyl)-5-[(sulfooxy)amino]-2-piperidinecarboxamide (English)

VGHMECNLFQGIJM-MNOVXSKESA-N

19 October 2016

InChIKey

1 reference

(2S,5R)-1-Formyl-N-(4-piperidinyl)-5-[(sulfooxy)amino]-2-piperidinecarboxamide (English)

19 October 2016

1 reference

(2S,5R)-1-Formyl-N-(4-piperidinyl)-5-[(sulfooxy)amino]-2-piperidinecarboxamide (English)

19 October 2016

2 references

RCSB PDB - MK7 Ligand Summary Page (English)

stated in

RCSB protein data bank

https://www.rcsb.org/ligand/MK7

24 February 2021

reference URL

matched by identifier from

InChIKey

VGHMECNLFQGIJM-MNOVXSKESA-N

1 reference

0 references

1 reference

4NK3 (English)