Chem
J-GLOBAL ID:201007056553085566   Nikkaji number:J2.812.195D

(2R,3R,4S)-3-Acetylamino-4-guanidino-2-[(1R,2R)-1-methoxy-2-hydroxy-3-(octanoyloxy)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid

(2R,3R,4S)-3-アセトアミド-4-グアニジノ-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
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-RMIBSVFLSA-N
SMILES: CCCCCCCC(=O)OC[C@@H](O)[C@@H](OC)[C@@H]1OC(=C[C@H](NC(=N)N)[C@H]1NC(=O)C)C(=O)O
Systematic name  (4):
  • (2R,3R,4S)-3-アセチルアミノ-4-グアニジノ-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
  • (2R,3R,4S)-3-アセチルアミノ-4-グアニジノ-2-[(1R,2R)-1-メトキシ-2-ヒドロキシ-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
  • (2R,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
  • (2R,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 (3):
  • (2R,3R,4S)-3-Acetylamino-4-guanidino-2-[(1R,2R)-2-hydroxy-1-methoxy-3-(octanoyloxy)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid
  • (2R,3R,4S)-3-アセトアミド-4-グアニジノ-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
  • (2R,3R,4S)-3-Acetylamino-4-guanidino-2-[(1R,2R)-1-methoxy-2-hydroxy-3-(octanoyloxy)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid
Regulation number (1):
  • 8-(4)-1744
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