HCID246167

6-Methylidene-3,20-dioxopregn-4-en-17-yl acetate

(17-acetyl-10,13-dimethyl-6-methylidene-3-oxo-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl) acetate

C24H32O4384.5 g/molCAS 32634-95-0

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IDENTITY

结构与身份

标准SMILES: C=C1CC2C(CCC3(C)C2CCC3(OC(C)=O)C(C)=O)C2(C)CCC(=O)C=C12
InChIKey: YCDZXIYKJHQMIG-UHFFFAOYSA-N
分子式: C24H32O4
平均分子量: 384.5 g/mol
单同位素质量: 384.2300595

COMPUTED

结构计算性质

等待补全

XLogP: 3.6
极性表面积: 60.4 Å²
氢键供体: 0
氢键受体: 4
可旋转键: 3
重原子: 28
形式电荷: 0
复杂度: 807

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 8 条

6-methylidene-3,20-dioxopregn-4-en-17-yl acetateNSC-58799NSC58799NCIOpen2_007924(17-acetyl-10,13-dimethyl-6-methylidene-3-oxo-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl) acetateDTXSID00954352YCDZXIYKJHQMIG-UHFFFAOYSA-N17-Hydroxy-6-methylenepregn-4-ene-3,20-dione-17-acetate;6-Methylene-17a-hydroxyprogesterone acetate

REACTIONS

参与反应

1 条

Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

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