基本情報
- CAS
71615-27-5- 標準SMILES
CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3C[C@H](C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C.C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1- InChIKey
NEDJKVIUOSOCNB-AWPSVMBFSA-N- 分子式
- C50H70O7
- 平均分子量
- 783.1 g/mol
- 単同位体質量
- 782.51215457
概要
See also: Estradiol cypionate; medroxyprogesterone acetate (annotation moved to).
名称と識別子
- 優先名称
- Pregn-4-ene-3,20-dione, 17-(acetyloxy)-6-methyl-, (6alpha)-, mixt. with (17beta)-3-hydroxyestra-1,3,5(10)-trien-17-yl cyclopentanepropanoate
- IUPAC
- [(6S,8R,9S,10R,13S,14S,17R)-17-acetyl-6,10,13-trimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate;[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] 3-cyclopentylpropanoate
- 英語名
- CycloProvera
- 分子式
- C26H36O3.C24H34O4
- 分子量
- 783.096
名称と別名
71615-27-5RefChem:1096594Pregn-4-ene-3,20-dione, 17-(acetyloxy)-6-methyl-, (6alpha)-, mixt. with (17beta)-3-hydroxyestra-1,3,5(10)-trien-17-yl cyclopentanepropanoateestradiol cypionate & medroxyprogesterone acetateestradiol cypionate + medroxyprogesterone acetateestradiol cypionate / medroxyprogesterone acetateestradiol cypionate and medroxyprogesterone acetateCycloproveraCyclofemLunelleHRP112HRP 112
名称をさらに表示
ESTRADIOL CYPIONATE MIXED WITH MEDROXYPROGESTERONE ACETATE
DTXSID40992177SCHEMBL30705034[(6S,8R,9S,10R,13S,14S,17R)-17-acetyl-6,10,13-trimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate;[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] 3-cyclopentylpropanoatePregn-4-ene-3,20-dione, 17-(acetyloxy)-6-methyl-, (6-alpha)-, mixt. with (17-beta)-3-hydroxyestra-1,3,5(10)-trien-17-yl cyclopentanepropanoate3-Hydroxyestra-1(10),2,4-trien-17-yl 3-cyclopentylpropanoate--6-methyl-3,20-dioxopregn-4-en-17-yl acetate (1/1)3-Hydroxyestra-1(10),2,4-trien-17beta-yl 3-cyclopentylpropanoate--6alpha-methyl-3,20-dioxopregn-4-en-17-yl acetate (1/1)
物性
構造計算による物性
- 極性表面積
- 107 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 7
- 回転可能結合数
- 8
- 重原子数
- 57
- 形式電荷
- 0
- 複雑度
- 1,360
関連反応
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