Chemical Compound

[(3S)-3-amino-3-carboxypropyl]-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium;butane-1,4-disulfonate;butane-1,4-disulfonic acid

CAS Registry Number 101020-79-5
[(3S)-3-amino-3-carboxypropyl]-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium;butane-1,4-disulfonate;butane-1,4-disulfonic acid 结构式
Primary record

[(3S)-3-amino-3-carboxypropyl]-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium;butane-1,4-disulfonate;butane-1,4-disulfonic acid

库存
8,087 克
纯度
98.5 %
CAS
101020-79-5

化合物标识与属性

CAS
101020-79-5
PubChem CID
73555139
SMILES
C[S+](CC[C@@H](C(=O)O)N)C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O.C[S+](CC[C@@H](C(=O)O)N)C[C@@H]1[C@H]([C@H]([C@@H](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.C(CCS(=O)(=O)[O-])CS(=O)(=O)[O-]
Canonical 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.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.O=S(=O)(O)CCCCS(=O)(=O)O.O=S(=O)(O)CCCCS(=O)(=O)O.O=S(=O)([O-])CCCCS(=O)(=O)[O-]

名称与同义词

  • SAMe-1,4-Butanedisulfonate
  • SAMe cpd
  • 101020-79-5
  • SAMe-14-Butanedisulfonate
  • Ademethionine 1,4-Butanedisulfonate
  • RefChem:931094
  • 6VTT3GH5KC
  • Ademetionine 1,4-butanedisulfonate
  • MFCD11111819
  • orb2939176
  • Ademetionine 1,4-Butandisulphate
  • S-Adenosylmethione-1,4-butanedisulfonate
  • Ademethionine 14-Butanedisulfonate
  • MFCD00871208
  • AKOS024259134
  • NA58198
  • AC-32157
  • AS-13888
  • AT-36407
  • S-Adenosylmethionine1,4-butanedisulfonate
  • SY273196
  • S-Adenosyl-L-Methionine 1,4-Butanedisulfonate
  • D83220
  • A897255
  • [(3S)-3-amino-3-carboxypropyl]-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium;butane-1,4-disulfonate;butane-1,4-disulfonic acid
  • (3S)-5'-[(3-Amino-3-carboxypropyl)methylsulfonio]-5'-deoxyadenosine 1,4-Butanedisulfonate 1,4-Butanedisulfonate (2:1:2)
  • (3S)-5-[(3-Amino-3-carboxypropyl)methylsulfonio]-5-deoxy-adenosine1,4-butanedisulfonate1,4-butanedisulfonate(2:1:2)
  • Adenosine, 5'-[[(3S)-3-amino-3-carboxypropyl]methylsulfonio]-5'-deoxy-, 1,4-butanedisulfonate (salt), 1,4-butanedisulfonate (salt) (2:1:2)