Chemical Compound
SAMe-1,4-Butanedisulfonate
CAS Registry Number
101020-79-5
Primary Record
SAMe-1,4-Butanedisulfonate
- In stock
- 8,087 g
- Purity
- 98.5 %
- CAS
- 101020-79-5
Compound Identifiers & Properties
- CAS
- 101020-79-5
- PubChem CID
- 169543840
- SMILES
- C[S+](CCC(C(=O)[O-])N)CC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O.C(CCS(=O)(=O)O)CS(=O)(=O)O.C(CCS(=O)(=O)[O-])CS(=O)(=O)O
- Canonical SMILES
- C[S+](CCC(N)C(=O)[O-])CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.O=S(=O)(O)CCCCS(=O)(=O)O.O=S(=O)([O-])CCCCS(=O)(=O)O
Names & Synonyms
- SAMe-1,4-Butanedisulfonate
- 101020-79-5
- butane-1,4-disulfonic acid (2S)-2-amino-4-({[5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl}(methyl)sulfaniumyl)butanoate 4-sulfobutane-1-sulfonate