聚[氧(1-甲基-2-氧代-1,2-乙二醇)],α-(1-氧代十八烷基)-w-羟基,钠盐(9CI) | 14777-17-4
聚[氧(1-甲基-2-氧代-1,2-乙二醇)],α-(1-氧代十八烷基)-w-羟基,钠盐(9CI)
Poly[oxy(1-methyl-2-oxo-1,2-ethanediyl)],a-(1-oxooctadecyl)-w-hydroxy-, sodium salt (9CI)
14777-17-4
C11H8O3
188.17942
名称和标识符
InChIKey |
ZMOIGGHUSNHCAB-UHFFFAOYSA-N |
Inchi |
InChI=1S/C11H8O3/c1-6-5-9(13)7-3-2-4-8(12)10(7)11(6)14/h2-5,12H,1H3 |
SMILES |
CC1=CC(=O)C2C=CC=C(O)C=2C1=O |
别名信息
- 英文别名 -
- Poly[oxy(1-methyl-2-oxo-1,2-ethanediyl)],a-(1-oxooctadecyl)-w-hydroxy-, sodium salt (9CI)
- Natristelate
- 5-hydroxy-3-methyl-1,4-naphthoquinone
- 8-Hydroxy-2-methyl-1,4-naphthalenedione
- 2-Methyl-8-hydroxy-1,4-naphthoquinone
- DTXSID701317990
- UNII-SW8KH5YY53
- CHEMBL1988478
- EN300-4274971
- 8-hydroxy-2-methyl-1,4-dihydronaphthalene-1,4-dione
- NSC654206
- 8-hydroxy-2-methylnaphthalene-1,4-dione
- 8-Hydroxy-2-methyl-1,4-naphthalenedione, 9CI
- 14777-17-4
- CHEBI:173524
- Naphthsaritone
- 1,4-Naphthalenedione, 8-hydroxy-2-methyl-
- 2-Methyl-8-oxidanyl-naphthalene-1,4-dione
- SW8KH5YY53
- CS-0530608
- Isoplumbagin
- NSC-654206
- SCHEMBL4304001
- AKOS006277326
- NCI60_018820
物化性质
计算特性
精确分子量 |
188.047 |
氢键供体数量 |
1 |
氢键受体数量 |
3 |
可旋转化学键数量 |
0 |
同位素质量 |
188.047 |
重原子数量 |
14 |
复杂度 |
317 |
同位素原子数量 |
0 |
确定原子立构中心数量 |
0 |
不确定原子立构中心数量 |
0 |
确定化学键立构中心数量 |
0 |
不确定化学键立构中心数量 |
0 |
共价键单元数量 |
1 |
疏水参数计算参考值(XlogP) |
2.3 |
拓扑分子极性表面积 |
54.4Ų |
聚[氧(1-甲基-2-氧代-1,2-乙二醇)],α-(1-氧代十八烷基)-w-羟基,钠盐(9CI)推荐生产厂家