(5-dimethylaminocarbonylpyrrolidin-3-ylthio)-6-(1-hydroxyethyl)penem-3-carboxylic acid (CAS 96036-10-1) — formula C15H21N3O5S2, molecular weight 387.5; category organic chemicals.
| CAS Number | 96036-10-1 |
|---|---|
| Molecular Formula | C15H21N3O5S2 |
| Molecular Weight | 387.5 |
| LogP | -2.1 |
| Category | Organic Chemicals |
(5-dimethylaminocarbonylpyrrolidin-3-ylthio)-6-(1-hydroxyethyl)penem-3-carboxylic acid is a carbon-based organic compound with CAS registry number 96036-10-1 and molecular formula C15H21N3O5S2 (molecular weight 387.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96036-10-1
Its molecular formula C15H21N3O5S2 comprises 15 C, 21 H, 3 N, 5 O, 2 S atoms.
Also known as: (5-dimethylaminocarbonylpyrrolidin-3-ylthio)-6-(1-hydroxyethyl)penem-3-carboxylic acid · (5-二甲基氨基羰基吡咯烷-3-硫基)-6-(1-羟乙基)青霉烯-3-甲酸
Category: organic chemicals
The CAS registry number of (5-dimethylaminocarbonylpyrrolidin-3-ylthio)-6-(1-hydroxyethyl)penem-3-carboxylic acid is 96036-10-1.
Molecular formula C15H21N3O5S2, molecular weight 387.5.
It is also registered under: (5-dimethylaminocarbonylpyrrolidin-3-ylthio)-6-(1-hydroxyethyl)penem-3-carboxylic acid, (5-二甲基氨基羰基吡咯烷-3-硫基)-6-(1-羟乙基)青霉烯-3-甲酸.
Category: Organic Chemicals.
Independent reference data for (5-dimethylaminocarbonylpyrrolidin-3-ylthio)-6-(1-hydroxyethyl)penem-3-carboxylic acid (CAS 96036-10-1), compiled from public chemistry databases.
| CAS 号 | 96036-10-1 |
|---|---|
| PubChem CID | 125871 |
| 分子式 | C15H21N3O5S2 |
| IUPAC 名称 | (5R,6S)-3-[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl-6-[(1R)-1-hydroxyethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid |
| Molecular Weight | 387.5 |
|---|---|
| XLogP3 | -2.1 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 387.09226313 |
| Monoisotopic Mass | 387.09226313 |
| Topological Polar Surface Area | 161 |
| Heavy Atom Count | 25 |
96036-10-1; (5-Dimethylaminocarbonylpyrrolidin-3-ylthio)-6-(1-hydroxyethyl)penem-3-carboxylic acid; 5-DPHPA; DTXSID40242104; RefChem:906205; DTXCID00164595; CHEMBL4176133; SCHEMBL21667223
(5-二甲基氨基羰基吡咯烷-3-硫基)-6-(1-羟乙基)青霉烯-3-甲酸 · CAS 96036-10-1 · C15H21N3O5S2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.