Chem
J-GLOBAL ID：200907083040903227   Nikkaji number：J7.666J

SAICAR

スクシノ-AICAR
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C13H19N4O12P
Molecular formula furigana： C13-H19-N4-O12-P
Molecular weight： 454.285
InChI： InChI=1S/C13H19N4O12P/c14-10-7(11(22)16-4(13(23)24)1-6(18)19)15-3-17(10)12-9(21)8(20)5(29-12)2-28-30(25,26)27/h3-5,8-9,12,20-21H,1-2,14H2,(H,16,22)(H,18,19)(H,23,24)(H2,25,26,27)/t4-,5+,8+,9+,12+/m0/s1
InChI key： NAQGHJTUZRHGAC-ZZZDFHIKSA-N
SMILES： Nc1c(ncn1[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O)C(=O)N[C@@H](CC(=O)O)C(=O)O
Systematic name  (3)：
  • N-[[5-アミノ-1-(5-O-ホスホノ-β-D-リボフラノシル)-1H-イミダゾール-4-イル]カルボニル]-L-アスパラギン酸
  • (2S)-2-({5-アミノ-1-[(2R,3R,4S,5R)-3,4-ジヒドロキシ-5-[(ホスホノオキシ)メチル]オキソラン-2-イル]-1H-イミダゾール-4-イル}ホルムアミド)ブタン二酸
  • (2S)-2-({5-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl]-1H-imidazol-4-yl}formamido)butanedioic acid
Other name (4)：
  • スクシノ-AICAR
  • SAICAR
  • Succino-AICAR
  • N-[[5-Amino-1-(5-O-phosphono-β-D-ribofuranosyl)-1H-imidazol-4-yl]carbonyl]-L-aspartic acid
CAS registry number： 3031-95-6
KEGG COMPOUND： C04823
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM