Chem
J-GLOBAL ID：200907040778657092   Nikkaji number：J1.824.934K

FC-131

FC-131
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： C36H47N11O6
Molecular formula furigana： C36-H47-N11-O6
Molecular weight： 729.843
InChI： InChI=1S/C36H47N11O6/c37-35(38)41-15-3-7-26-32(51)45-27(8-4-16-42-36(39)40)33(52)47-28(19-22-9-12-23-5-1-2-6-24(23)17-22)31(50)43-20-30(49)44-29(34(53)46-26)18-21-10-13-25(48)14-11-21/h1-2,5-6,9-14,17,26-29,48H,3-4,7-8,15-16,18-20H2,(H,43,50)(H,44,49)(H,45,51)(H,46,53)(H,47,52)(H4,37,38,41)(H4,39,40,42)/t26-,27-,28-,29+/m0/s1
InChI key： MBXBICVKLVYNKD-XFTNXAEASA-N
SMILES： NC(=N)NCCC[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CNC(=O)[C@H](Cc2ccc3ccccc3c2)NC1=O
Systematic name  (8)：
  • シクロ(L-Arg-L-Arg-L-βNal-Gly-D-Tyr-)
  • シクロ(D-Tyr-L-Arg-L-Arg-L-βNal-Gly-)
  • 3-(2-ナフチル)シクロ(L-Ala-Gly-D-Tyr-L-Arg-L-Arg-)
  • シクロ[D-Tyr-L-Arg-L-Arg-3-(2-ナフチル)-L-Ala-Gly-]
  • 2β,14β-ビス(3-グアニジノプロピル)-5β-(2-ナフチルメチル)-11α-(4-ヒドロキシベンジル)-1,4,7,10,13-ペンタアザシクロペンタデカン-3,6,9,12,15-ペンタオン
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Other name (10)：
  • Cyclo(L-Arg-L-Arg-L-βNal-Gly-D-Tyr-)
  • Cyclo(D-Tyr-L-Arg-L-Arg-L-βNal-Gly-)
  • FC131
  • シクロ(-D-Tyr-Arg-Arg-Nal-Gly-)
  • Cyclo(-D-Tyr-Arg-Arg-Nal-Gly-)
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Thsaurus map：
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