Chem
J-GLOBAL ID：200907097017640660   Nikkaji number：J2.764.882G

N-Acetyl-O-demethylpuromycin

N-アセチル-O-デメチルプロマイシン
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： C23H29N7O6
Molecular formula furigana： C23-H29-N7-O6
Molecular weight： 499.528
InChI： InChI=1S/C23H29N7O6/c1-12(32)27-15(8-13-4-6-14(33)7-5-13)22(35)28-17-16(9-31)36-23(19(17)34)30-11-26-18-20(29(2)3)24-10-25-21(18)30/h4-7,10-11,15-17,19,23,31,33-34H,8-9H2,1-3H3,(H,27,32)(H,28,35)/t15-,16+,17+,19+,23+/m0/s1
InChI key： ZMYRMMCUDKHWQQ-PXBBLBRZSA-N
SMILES： CN(C)c1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)C)[C@H]1O
Systematic name  (3)：
  • N,N-ジメチル-3′-(N-アセチル-L-チロシルアミノ)-3′-デオキシアデノシン
  • (2S)-N-[(2S,3S,4R,5R)-5-[6-(ジメチルアミノ)-9H-プリン-9-イル]-4-ヒドロキシ-2-(ヒドロキシメチル)オキソラン-3-イル]-2-アセトアミド-3-(4-ヒドロキシフェニル)プロパンアミド
  • (2S)-N-[(2S,3S,4R,5R)-5-[6-(dimethylamino)-9H-purin-9-yl]-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]-2-acetamido-3-(4-hydroxyphenyl)propanamide
Other name (3)：
  • N,N-Dimethyl-3′-(N-acetyl-L-tyrosylamino)-3′-deoxyadenosine
  • N-Acetyl-O-demethylpuromycin
  • N-アセチル-O-デメチルプロマイシン
KEGG COMPOUND： C07031
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