sitagliptin (Q419832)

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chemical compound
  • Januvia®
  • MK-0431
  • Sitagliptin
  • Sitagliptine
  • (2R)-4-OXO-4-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-(2,4,5-trifluorophenyl)butan-2-amine
  • Sitagliptina
  • Sitagliptin phosphate
  • Sitagliptan
  • Sitagliptinum
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Language Label Description Also known as
English
sitagliptin
chemical compound
  • Januvia®
  • MK-0431
  • Sitagliptin
  • Sitagliptine
  • (2R)-4-OXO-4-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-(2,4,5-trifluorophenyl)butan-2-amine
  • Sitagliptina
  • Sitagliptin phosphate
  • Sitagliptan
  • Sitagliptinum

Statements

has use
medication
0 references
mass
407.118 dalton
1 reference
stated in
PubChem
PubChem CID
4369359
language of work or name
English
title
Sitagliptin (English)
retrieved
19 October 2016
chemical formula
C₁₆H₁₅F₆N₅O
1 reference
stated in
PubChem
PubChem CID
4369359
language of work or name
English
title
Sitagliptin (English)
retrieved
19 November 2016
canonical SMILES
C1CN2C(=NN=C2C(F)(F)F)CN1C(=O)CC(CC3=CC(=C(C=C3F)F)F)N
1 reference
stated in
PubChem
PubChem CID
4369359
language of work or name
English
title
Sitagliptin (English)
retrieved
19 November 2016
isomeric SMILES
C1CN2C(=NN=C2C(F)(F)F)CN1C(=O)C[C@@H](CC3=CC(=C(C=C3F)F)F)N
1 reference
stated in
PubChem
PubChem CID
4369359
language of work or name
English
title
Sitagliptin (English)
retrieved
19 November 2016
Commons category
Sitagliptin
0 references

Identifiers

Reaxys registry number
9962060
1 reference
stated in
ChEBI
ChEBI ID
40237
language of work or name
English
title
sitagliptin (English)
retrieved
19 October 2016
HSDB ID
7516
1 reference
stated in
Hazardous Substances Data Bank
HSDB ID
7516
publication date
28 October 2019
title
SITAGLIPTIN (English)
retrieved
10 May 2021
LiverTox ID
Sitagliptin
0 references
EC number
690-730-1
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.217.948
retrieved
27 December 2018
title
(3R)-3-amino-1-[3-(trifluoromethyl)-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one (English)
quotation
CAS no.: 486460-32-6 (English)
ECHA Substance Infocard ID
100.217.948
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.217.948
retrieved
27 December 2018
title
(3R)-3-amino-1-[3-(trifluoromethyl)-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one (English)
quotation
CAS no.: 486460-32-6 (English)
MeSH descriptor ID
D000068900
subject named as
Sitagliptin Phosphate
0 references
MeSH concept ID
M0480815
0 references
KEGG ID
D08516
1 reference
stated in
ChEBI
ChEBI ID
40237
language of work or name
English
title
sitagliptin (English)
retrieved
19 October 2016
PDB ligand ID
715
0 references
CAB ID
134851
1 reference
stated in
CAB Thesaurus
retrieved
6 April 2020
 
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