Estra-1,3,5(10)-trien-17-one,2,4,16-tribromo-3-hydroxy-, (16a)- (9CI) (CAS 25577-72-4) — formula C26H35NO11S, molecular weight 569.6; category organic chemicals.
Documented applications: Used in cosmetics, plastics, and lubricants..
Estra-1,3,5(10)-trien-17-one,2,4,16-tribromo-3-hydroxy-, (16a)- (9CI) is a carbon-based organic compound with CAS registry number 25577-72-4 and molecular formula C26H35NO11S (molecular weight 569.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 25577-72-4
Its molecular formula C26H35NO11S comprises 26 C, 35 H, 1 N, 11 O, 1 S atoms.
Also known as: Estra-1,3,5(10)-trien-17-one,2,4,16-tribromo-3-hydroxy-, (16a)- (9CI) · estra-1,3,5(10)-triene-3,17β-diol 3-[bis(2-chloroethyl)carbamate] 17-(dihydrogen phosphate)
Category: organic chemicals
The CAS registry number of Estra-1,3,5(10)-trien-17-one,2,4,16-tribromo-3-hydroxy-, (16a)- (9CI) is 25577-72-4.
Molecular formula C26H35NO11S, molecular weight 569.6.
It is also registered under: Estra-1,3,5(10)-trien-17-one,2,4,16-tribromo-3-hydroxy-, (16a)- (9CI), estra-1,3,5(10)-triene-3,17β-diol 3-[bis(2-chloroethyl)carbamate] 17-(dihydrogen phosphate).
Recorded applications: Used in cosmetics, plastics, and lubricants..
Category: Organic Chemicals.
Public-database records for Estra-1,3,5(10)-trien-17-one,2,4,16-tribromo-3-hydroxy-, (16a)- (9CI) (CAS 25577-72-4), reproduced here for independent cross-checking.
| CAS Registry Number | 25577-72-4 |
|---|---|
| PubChem CID | 130476821 |
| 分子式 | C26H35NO11S |
| IUPAC 名称 | [(8R,9S,13S,14S,15S)-15-[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate |
15alpha-Hydroxyestrone sulfo-N-acetylglucosaminide; 15alpha-Hydroxyestrone-3-sulfo-15-N-acetylglucosaminide; 15alpha-Hydroxyestrone 3-sulfate 15-N-acetylglucosaminide; 15alpha-((2-(Acetylamino)-2-deoxy-beta-D-glucopyranosyl)oxy)-3-(sulfooxy)estra-1,3,5(10)-trien-17-one; 25577-72-4; 3-Sulfato-17-oxoestra-1,3,5(10)-trien-15alpha-yl-2'-acetamido-2'-deoxy-beta-D-glucopyranoside
| 分子量 | 569.6 |
|---|---|
| XLogP3 | 0.4 |
| 氢键供体数 | 5 |
| 氢键受体数 | 11 |
| 可旋转键数 | 6 |
| 精确质量 | 569.19308211 |
| 单同位素质量 | 569.19308211 |
| 拓扑极性表面积 | 197 |
| 重原子数 | 39 |
| 形式电荷 | 0 |
Estra-1,3,5(10)-trien-17-one,2,4,16-tribromo-3-hydroxy-, (16a)- (9CI) · CAS 25577-72-4 · C26H35NO11S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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