Feedback

gemcitabine

Properties

Image

Occurences in reactions

MNX_ID

MNXM18032

	#reac
in my sandbox	0
in MNXref (generic)	11
in models (compartimentalized)	0

formula

C₉H₁₁F₂N₃O₄

charge

mass

263.07176

reference

InChIKey

SDUQYLNIPVEERB-QPPQHZFASA-N

InChI

InChI=1S/C9H11F2N3O4/c10-9(11)6(16)4(3-15)18-7(9)14-2-1-5(12)13-8(14)17/h1-2,4,6-7,15-16H,3H2,(H2,12,13,17)/t4-,6-,7-/m1/s1

SMILES

Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)C2(F)F)c(=O)n1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:175901 chebi:175901	gemcitabine 2',2'-Difluorodeoxycytidine 2'-Deoxy-2',2'-difluorocytidine 2'-deoxy-2',2'-difluorocytidine 4-amino-1-((2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)pyrimidin-2(1H)-one gemcitabina gemcitabinum
sabiork.compound:9754 sabiorkM:9754 seed.compound:cpd04811 seedM:cpd04811 kegg.compound:C07650 keggC:C07650	Gemcitabine
kegg.drug:D02368 keggD:D02368	Gemcitabine (USAN/INN)
hmdb:HMDB0014584	Gemcitabine 2',2'-DFDC 2',2'-Difluoro-2'-deoxycytidine 2',2'-Difluorodeoxycytidine 2'-Deoxy-2',2''-difluorocytidine-5'-O-monophosphate 2'-Deoxy-2',2'-difluorocytidine 2'-Deoxy-2'-difluorocytidine 4-Amino-1-((2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)pyrimidin-2(1H)-one 4-amino-1-[(2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one DFdCyd Gemcitabina Gemcitabine hydrochloride Gemcitabine, (D-threo-pentafuranosyl)-isomer Gemcitabine, (alpha-D-threo-pentofuranosyl)-isomer Gemcitabine, (beta-D-threo-pentafuranosyl)-isomer Gemcitabinum Gemzar gemcitabine
hmdb:HMDB14584 chebi:42752 chebi:5295 keggC:M_C07650 keggD:M_D02368 seedM:M_cpd04811	secondary/obsolete/fantasy identifier