HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 34756Erstellt: 27. Oktober 2026
S-adenosyl-L-methionine
13CH3-SAM · Methionine,active · S-ADENOSYLMETHIONINE · Adenosine Impurity 39 · S-(5'-Adenosyl)methionine · MEFKEPWMEQBLKI-AIRLBKTGSA-O · S-adenosylmethionine USP/EP/BP · Ademetionine 1,4-Butanedisulfonate Impurity 18 Monomer
https://huagongshe.com/de/chemical/34756
Identifikatoren & physikalische Daten
| CAS No. | 485-80-3 |
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| Summenformel | C15H23N6O5S+ |
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| Durchschnittliche Molmasse | 399,4 g/mol |
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| Monoisotopische Masse | 399,14451526 g/mol |
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| SMILES | C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O |
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| InChIKey | MEFKEPWMEQBLKI-AIRLBKTGSA-O |
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| PubChem CID | 34756 |
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| ChEMBL | CHEMBL224120 |
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| ChEBI | CHEBI:15414 |
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| DTXSID | DTXSID20110014 |
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Chemische & physikalische Eigenschaften
| XLogP | -3,5 |
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| Polarare Oberfläche (TPSA) | 184 |
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| H-Brücken-Donoren | 5 |
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| H-Brücken-Akzeptoren | 10 |
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| Frei drehbare Bindungen | 7 |
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| Schwere Atome | 27 |
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| Formalladung | 1 |
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| Komplexität | 533 |
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| Arzneimittel | Pharmaceuticals -> Listed in ZINC15 |
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| LogP (Verteilungskoeffizient) | -5.3 |
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| Siedepunkt | 78 °C |
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| Physical Description | Solid |
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| Collision Cross Section | 185.6 Ų [M+H]+ |
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| InChIKey | QOWKLNSTGYYNGX-MDHPBGAINA-N |
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| SMILES | C(O)(=O)[C@H](CCS(C[C@H]1O[C@@H](N2C3=C(C(=NC=N3)N)N=C2)[C@H](O)[C@@H]1O)C)N |&1:3,8,10,21,23,r| |
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Sicherheit & Vorschriften
| Expositionspfade | S-Adenosylmethionine is absorbed from the small intestine following oral intake. As absorption is affected by food, it is best to take on an empty stomach. Bioavailability is low following oral intake. |
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| Toxizitätsübersicht | S-Adenosylmethionine (SAMe) is a natural substance present in the cells of the body. It is a direct metabolite of the essential amino acid L-methionine. SAMe plays a crucial biochemical role in the body by donating a one-carbon methyl group in a process called transmethylation. SAMe, formed from the reaction of L-methionine and adenosine triphosphate catalyzed by the enzyme S-adenosylmethionine synthetase, is the methyl-group donor in the biosynthesis of both DNA and RNA nucleic acids, phospholipids, proteins, epinephrine, melatonin, creatine and other molecules. |
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| Carcinogen Classification | No indication of carcinogenicity to humans (not listed by IARC). |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
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