Chem
J-GLOBAL ID:200907077645753138   Nikkaji number:J1.529.526K

(2R)-N-[(1S)-1-(1H-Tetrazole-5-yl)-2-phenylethyl]-2-[(8-guanidinooctanoyl)amino]-3-carboxypropanamide

(2R)-N-[(1S)-1-(1H-テトラゾール-5-イル)-2-フェニルエチル]-2-[(8-グアニジノオクタノイル)アミノ]-3-カルボキシプロパンアミド
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: C22H33N9O4
Molecular formula furigana: C22-H33-N9-O4
Molecular weight: 487.565
InChI: InChI=1S/C22H33N9O4/c23-22(24)25-12-8-3-1-2-7-11-18(32)26-17(14-19(33)34)21(35)27-16(20-28-30-31-29-20)13-15-9-5-4-6-10-15/h4-6,9-10,16-17H,1-3,7-8,11-14H2,(H,26,32)(H,27,35)(H,33,34)(H4,23,24,25)(H,28,29,30,31)/t16-,17+/m0/s1
InChI key: YRUSFCAYUXAHRN-DLBZAZTESA-N
SMILES: NC(=N)NCCCCCCCC(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)c1nnn[nH]1
Systematic name  (3):
  • (2R)-N-[(1S)-1-(1H-テトラゾール-5-イル)-2-フェニルエチル]-2-[(8-グアニジノオクタノイル)アミノ]-3-カルボキシプロパンアミド
  • (3R)-3-(8-カルバムイミドアミドオクタンアミド)-3-{[(1S)-2-フェニル-1-(1H-1,2,3,4-テトラゾール-5-イル)エチル]カルバモイル}プロパン酸
  • (3R)-3-(8-carbamimidamidooctanamido)-3-{[(1S)-2-phenyl-1-(1H-1,2,3,4-tetrazol-5-yl)ethyl]carbamoyl}propanoic acid
Other name (1):
  • (2R)-N-[(1S)-1-(1H-Tetrazole-5-yl)-2-phenylethyl]-2-[(8-guanidinooctanoyl)amino]-3-carboxypropanamide
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