3-hydroxypregnan-3-one 3-sulfate (CAS 7730-00-9) — formula C21H34O5S, molecular weight 398.6; category organic chemicals.
| CAS Number | 7730-00-9 |
|---|---|
| Molecular Formula | C21H34O5S |
| Molecular Weight | 398.6 |
| LogP | 4.5 |
| Category | Organic Chemicals |
3-hydroxypregnan-3-one 3-sulfate is a carbon-based organic compound with CAS registry number 7730-00-9 and molecular formula C21H34O5S (molecular weight 398.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 7730-00-9
Its molecular formula C21H34O5S comprises 21 C, 34 H, 5 O, 1 S atoms.
Also known as: 3-hydroxypregnan-3-one 3-sulfate · 3-羟基孕烷-3-酮3-硫酸酯
Category: organic chemicals
The CAS registry number of 3-hydroxypregnan-3-one 3-sulfate is 7730-00-9.
Molecular formula C21H34O5S, molecular weight 398.6.
It is also registered under: 3-hydroxypregnan-3-one 3-sulfate, 3-羟基孕烷-3-酮3-硫酸酯.
Category: Organic Chemicals.
Independent reference data for 3-hydroxypregnan-3-one 3-sulfate (CAS 7730-00-9), compiled from public chemistry databases.
| CAS 号 | 7730-00-9 |
|---|---|
| PubChem CID | 3080643 |
| 分子式 | C21H34O5S |
| IUPAC 名称 | [(3S,5S,8R,9S,10S,13S,14S,17S)-17-acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate |
| UNII（FDA） | A39RY7Z3WG |
| Molecular Weight | 398.6 |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 398.21269535 |
| Monoisotopic Mass | 398.21269535 |
| Topological Polar Surface Area | 89.1 |
| Heavy Atom Count | 27 |
HPOS; 7730-00-9; 3-Hydroxypregnan-3-one 3-sulfate; A39RY7Z3WG; Pregnan-20-one, 3-(sulfooxy)-, (3beta,5alpha)-; BA 2782; allopregnanolone sulfate; RefChem:915420; 3BETA-HYDROXY-5ALPHA-DIHYDROPROGESTERONE SULFATE; 3alpha-Hydroxy-5alpha-pregnan-20-one sulfate; UNII-A39RY7Z3WG; 3beta-Hydroxy-5alpha-pregnan-20-one 3-sulfate; 3beta-Hydroxy-5 alpha-pregnan-20-one 3-sulfate; DTXSID30998547; SCHEMBL4198024; CHEBI:233432
3-羟基孕烷-3-酮3-硫酸酯 · CAS 7730-00-9 · C21H34O5S. UNII A39RY7Z3WG.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-羟基孕烷-3-酮3-硫酸酯