Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- CC(=O)OC1OC(COC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C1OC(=O)c1ccccc1
- InChIKey
- GCZABPLTDYVJMP-UHFFFAOYSA-N
- 分子式
- C28H24O9
- 平均分子量
- 504.5 g/mol
- 单同位素质量
- 504.14203234
COMPUTED
结构计算性质
- XLogP
- 5.6
- 极性表面积
- 114 Ų
- 氢键供体
- 0
- 氢键受体
- 9
- 可旋转键
- 12
- 重原子
- 37
- 形式电荷
- 0
- 复杂度
- 793
ALIASES
名称与别名
(5-ACETYLOXY-3,4-DIBENZOYLOXY-OXOLAN-2-YL)METHYL BENZOATEC28H24O9NSC-23349NSC23349b-L-Ribofuranose 1-acetate 2,3,5-tribenzoateClofarabine Impurity 191-O-Acetyl-2,3,5-tri-O-benzoyl-b-L-ribofuranoseSCHEMBL10117984DTXSID60953008(2R,3S,4S,5S)-2-acetoxy-5-(benzoyloxymethyl)tetrahydrofuran-3,4-diyl dibenzoate[(2R,3R,4R)-5-acetoxy-3,4-dibenzoyloxy-tetrahydrofuran-2-yl]methyl benzoate(2R,3R,4R)-5-(ACETYLOXY)-4-(BENZOYLOXY)-2-[(BENZOYLOXY)METHYL]OXOLAN-3-YL BENZOATE(5-acetoxy-3,4-dibenzoyloxy-tetrahydrofuran-2-yl)methyl benzoateBBA28772NSC87674NSC-87674NSC164682AKOS001726284AKOS022016279NSC-164682
REACTIONS
相关反应
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D
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