Chem
J-GLOBAL ID:200907050436524819   Nikkaji number:J924.322D

(S)-3-(3-Amidinophenyl)-7-(4-guanidinophenyl)heptanoic acid methyl ester

(S)-3-(3-アミジノフェニル)-7-(4-グアニジノフェニル)ヘプタン酸メチル
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: C22H29N5O2
Molecular formula furigana: C22-H29-N5-O2
Molecular weight: 395.507
InChI: InChI=1S/C22H29N5O2/c1-29-20(28)14-17(16-7-4-8-18(13-16)21(23)24)6-3-2-5-15-9-11-19(12-10-15)27-22(25)26/h4,7-13,17H,2-3,5-6,14H2,1H3,(H3,23,24)(H4,25,26,27)/t17-/m0/s1
InChI key: FKTIPOLHKSMAHY-KRWDZBQOSA-N
SMILES: COC(=O)C[C@H](CCCCc1ccc(NC(=N)N)cc1)c1cccc(c1)C(=N)N
Systematic name  (3):
  • (S)-3-(3-アミジノフェニル)-7-(4-グアニジノフェニル)ヘプタン酸メチル
  • メチル (3S)-7-(4-カルバムイミドアミドフェニル)-3-(3-カルバムイミドイルフェニル)ヘプタノアート
  • methyl (3S)-7-(4-carbamimidamidophenyl)-3-(3-carbamimidoylphenyl)heptanoate
Other name (1):
  • (S)-3-(3-Amidinophenyl)-7-(4-guanidinophenyl)heptanoic acid methyl ester
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