Chem
J-GLOBAL ID：200907002073435571   Nikkaji number：J1.809.773G

5′-O-[6-[3-(2-Carboxyethyldithio)propionylamino]hexyl]-2′-deoxy-3′-guanylic acid

5′-O-[6-[3-(2-カルボキシエチルジチオ)プロピオニルアミノ]ヘキシル]-2′-デオキシ-3′-グアニル酸
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： C22H35N6O10PS2
Molecular formula furigana： C22-H35-N6-O10-P-S2
Molecular weight： 638.650
InChI： InChI=1S/C22H35N6O10PS2/c23-22-26-20-19(21(32)27-22)25-13-28(20)17-11-14(38-39(33,34)35)15(37-17)12-36-8-4-2-1-3-7-24-16(29)5-9-40-41-10-6-18(30)31/h13-15,17H,1-12H2,(H,24,29)(H,30,31)(H2,33,34,35)(H3,23,26,27,32)/t14-,15+,17+/m0/s1
InChI key： WUYUKWDKNXYQNK-ZMSDIMECSA-N
SMILES： Nc1nc2n(cnc2c(=O)[nH]1)[C@H]1C[C@H](OP(=O)(O)O)[C@@H](COCCCCCCNC(=O)CCSSCCC(=O)O)O1
Systematic name  (3)：
  • 5′-O-[6-[3-(2-カルボキシエチルジチオ)プロピオニルアミノ]ヘキシル]-2′-デオキシ-3′-グアニル酸
  • 3-({2-[(6-{[(2R,3S,5R)-5-(2-アミノ-6-オキソ-6,9-ジヒドロ-1H-プリン-9-イル)-3-(ホスホノオキシ)オキソラン-2-イル]メトキシ}ヘキシル)カルバモイル]エチル}ジスルファニル)プロパン酸
  • 3-({2-[(6-{[(2R,3S,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-3-(phosphonooxy)oxolan-2-yl]methoxy}hexyl)carbamoyl]ethyl}disulfanyl)propanoic acid
Other name (1)：
  • 5′-O-[6-[3-(2-Carboxyethyldithio)propionylamino]hexyl]-2′-deoxy-3′-guanylic acid
Thsaurus map：
Thesaurus Map

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