Chem
J-GLOBAL ID：200907041281471307   Nikkaji number：J2.098.412K

CS-8958

CS-8958
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： C21H36N4O8
Molecular formula furigana： C21-H36-N4-O8
Molecular weight： 472.539
InChI： InChI=1S/C21H36N4O8/c1-4-5-6-7-8-9-16(28)32-11-14(27)18(31-3)19-17(24-12(2)26)13(25-21(22)23)10-15(33-19)20(29)30/h10,13-14,17-19,27H,4-9,11H2,1-3H3,(H,24,26)(H,29,30)(H4,22,23,25)/t13-,14+,17+,18+,19?/m0/s1
InChI key： UKTIJASCFRNWCB-SOHMKMCVSA-N
SMILES： CCCCCCCC(=O)OC[C@@H](O)[C@@H](OC)C1OC(=C[C@H](NC(=N)N)[C@H]1NC(=O)C)C(=O)O
Systematic name  (3)：
  • 5,6-ジヒドロ-4α-グアニジノ-5β-(アセチルアミノ)-6-[(1R,2R)-2-ヒドロキシ-1-メトキシ-3-(オクタノイルオキシ)プロピル]-4H-ピラン-2-カルボン酸
  • (3R,4S)-4-カルバムイミドアミド-3-アセトアミド-2-[(1R,2R)-2-ヒドロキシ-1-メトキシ-3-(オクタノイルオキシ)プロピル]-3,4-ジヒドロ-2H-ピラン-6-カルボン酸
  • (3R,4S)-4-carbamimidamido-3-acetamido-2-[(1R,2R)-2-hydroxy-1-methoxy-3-(octanoyloxy)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid
Other name (4)：
  • オクタン酸ラニナミビル
  • CS-8958
  • 5,6-Dihydro-4α-guanidino-5β-(acetylamino)-6-[(1R,2R)-2-hydroxy-1-methoxy-3-(octanoyloxy)propyl]-4H-pyran-2-carboxylic acid
  • Laninamivir octanoate
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