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Structure
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| Relationships |
Total Number of functionally related protein(s) :
1593
Total Number of Articles : 3014
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| PubChem |
60750
|
| Molecular Formula |
C9H11F2N3O4 |
| SMILES |
C1=CN(C(=O)N=C1N)[C@H]2C([C@@H]([C@H](O2)CO)O)(F)F |
| 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 |
| synonyms |
- gemcitabine
- 95058-81-4
- 2'-Deoxy-2',2'-difluorocytidine
- 2',2'-Difluorodeoxycytidine
- Cytidine, 2'-deoxy-2',2'-difluoro-
- dFdC
- Gemcitabine free base
- GEMCITABINE HYDROCHLORIDE
- 2',2'-difluoro-2'-deoxycytidine
- 103882-84-4
- 4-amino-1-[(2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one
- LY188011
- 4-amino-1-((2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one
- 95058-81-4 (free base)
- B76N6SBZ8R
- LY 188011
- 4-Amino-1-[(2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
- Gamcitabine
- Gemcitabina
- CHEBI:175901
- DFdCyd
- NSC-613327
- Gemcitabinum
- Folfugem
- Gemcel
- Zefei
- GemLip
- 4-amino-1-((2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)pyrimidin-2(1H)-one
- Gemcitabinum [INN-Latin]
- Gemcitabina [INN-Spanish]
Click to show/hide the synonyms
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| Properties |
| Property |
Value |
| MW |
263.20 g/mol |
| HBD |
3 |
| HBA |
6 |
| Rotatable Bond Count |
2 |
| Exact Mass |
263.07176216 g/mol |
| Monoisotopic Mass |
263.07176216 g/mol |
| Heavy Atom Count |
18 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
3 |
| Covalent Unit Count |
1 |
| Complexity |
426 |
| xlogp |
-1.5 |
| Topological Polar Surface Area |
108 |
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