Basic information
- Standard SMILES
CC(=O)OCC(COC(C)=O)OCn1cnc2c(=O)[nH]c(N)nc21- InChIKey
NSZKHEYZLNPIEJ-UHFFFAOYSA-N- Molecular formula
- C13H17N5O6
- Average molar mass
- 339.3 g/mol
Names & identifiers
- Preferred name
- Ganciclovir Di-O-acetate
- IUPAC
- [3-acetyloxy-2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]propyl] acetate
- English name
- 9-(1,3-diacetate-2-propoxymethyl)guanine
- Molecular formula
- C13H17N5O6
- Molecular weight
- 339.3
Names & synonyms
86357-19-9Ganciclovir Di-O-acetateGanciclovir Impurity 112-((2-amino-6-oxo-1H-purin-9(6H)-yl)methoxy)propane-1,3-diyl diacetate6H-Purin-6-one, 9-[[2-(acetyloxy)-1-[(acetyloxy)methyl]ethoxy]methyl]-2-amino-1,9-dihydro-NG7NB2E3G7CHEMBL122526SCHEMBL9583727NSZKHEYZLNPIEJ-UHFFFAOYSA-N2-((2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methoxy)propane-1,3-diyl diacetate9-(1,3-Diacetoxy-2-propoxymethyl)guanine9-(1,3-diacetyloxy-2-propoxymethyl)guanine
Show more names
GXLW-IM-108Ganciclovir DiacetateGanciclovir Impurity 28Ganciclovir impurities811Ciprofloxacin Impurity 22iso-Ganciclovir TriacetateGanciclovir Diacetyl Impurityvalganciclovirhydrochloride iMpurit 1
Ganciclovir Impurity 28(Ganciclovir Diacetate)[3-acetoxy-2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]propyl] acetate9-[[2-(Acetyloxy)-1-[(acetyloxy)methyl]ethoxy]methyl]-2-amino-1,9-dihydro-6H-purin-6-one9-[[2-(Acetyloxy)-1-[(acetyloxy)methyl]ethoxy]methyl]-2-amino-1,9-dihydro-6H-purin-6-one; Ganciclovir Di-O-acetate; 6H-Purin-6-one, 9-[[2-(acetyloxy)-1-[(acetyloxy)methyl]ethoxy]methyl]-2-amino-1,9-dihydro-
Database identifiers
- CAS
86357-19-9- PubChem CID
- 135459822
- ChEMBL
CHEMBL122526- UNII
- NG7NB2E3G7
- Nikkaji
- J3.531.527F
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 147 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 521
Physicochemical properties
- Melting point
- 238 °C · 238°C
- Boiling point
- 475.29 °C · 475.29°C (rough estimate)
- Density
- 1.3014 · 1.3014 (rough estimate)
- refractive index
- 1.65 · 1.6500 (estimate)
- Water Solubility
- 0.58 g/L · 0.58g/L(25 ºC)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers19 total
艾吉析科技(上海)有限公司17717235263 · [email protected]
怀化元研达生物技术有限责任公司18711085600 · [email protected]
广州佳途科技股份有限公司81960175 18933936954 · [email protected]
怀化元研达生物技术有限责任公司18711085600; 18229999901 · [email protected]
上海澜克医药科技有限公司021-52216295 lankepharma
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
北京康派森医药科技有限公司010-010-52878169 15801002657 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
深圳卓越生物医药科技有限公司0755-26050679 18318671572 · [email protected]
石家庄耀博医药科技有限公司15633056635 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
雷丁科技0510-85629785 18013409632 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
上海语锌医药科技有限公司15921286451; 15921286451 · [email protected]
梯尔希(南京)药物研发有限公司18012923235 · [email protected]
Hangzhou Huarong Pharm Co., Ltd.571-86758373 +8613588754946 · [email protected]
卡托研究化学公司+86-020-81960175-877 4000-868-328;4000-868-328 · [email protected]
Related reactions
9 records
Linked notes
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