Pantethine (CAS 16816-67-4) — formula C22H42N4O8S2, molecular weight 554.7.
Pantethine is a chemical compound with CAS registry number 16816-67-4 and molecular formula C22H42N4O8S2 (molecular weight 554.7).
CAS number: 16816-67-4
Its molecular formula C22H42N4O8S2 comprises 22 C, 42 H, 4 N, 8 O, 2 S atoms.
Also known as: Pantethine · D-Pantethine
The CAS registry number of Pantethine is 16816-67-4.
Molecular formula C22H42N4O8S2, molecular weight 554.7.
It is also registered under: Pantethine, D-Pantethine.
Public-database records for Pantethine (CAS 16816-67-4), reproduced here for independent cross-checking.
| CAS Registry Number | 16816-67-4 |
|---|---|
| PubChem CID | 4677 |
| 分子式 | C22H42N4O8S2 |
| IUPAC 名称 | N-[3-[2-[2-[3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoylamino]ethyldisulfanyl]ethylamino]-3-oxopropyl]-2,4-dihydroxy-3,3-dimethylbutanamide |
| UNII（FDA） | HMS3264G11 |
138148-35-3; D-pantethine anhydrous; Bis-pantethine; Pantosin (TN); Butanamide, N,N'-[dithiobis[2,1-ethanediylimino(3-oxo-3,1-propanediyl)]]bis[2,4-dihydroxy-3,3-dimethyl- (9CI); D-Pantethine;LBF disulfide; SR-05000002047; LBF factor; Pantethine (JP18); SCHEMBL59597; CHEMBL3184321; CHEBI:181909; DTXSID801015707; HMS3264G11; Pharmakon1600-01505920; NSC759269
| 分子量 | 554.7 |
|---|---|
| XLogP3 | -2.2 |
| 氢键供体数 | 8 |
| 氢键受体数 | 10 |
| 可旋转键数 | 19 |
| 精确质量 | 554.24440666 |
| 单同位素质量 | 554.24440666 |
| 拓扑极性表面积 | 248 |
| 重原子数 | 36 |
| 形式电荷 | 0 |
Pantethine · CAS 16816-67-4 · C22H42N4O8S2. UNII HMS3264G11.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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