Chem
J-GLOBAL ID:200907027018491597   Nikkaji number:J2.037.697J

Z-L-Arg-N6-(Z-L-Arg-)D-Lys-N6-[Z-L-Arg-N6-(Z-L-Arg-)D-Lys-]D-Lys-L-Phe-NH2

Z-L-Arg-N6-(Z-L-Arg-)D-Lys-N6-[Z-L-Arg-N6-(Z-L-Arg-)D-Lys-]D-Lys-L-Phe-NH2
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: C83H120N24O16
Molecular formula furigana: C83-H120-N24-O16
Molecular weight: 1710.025
InChI: InChI=1S/C83H120N24O16/c84-68(108)67(50-55-26-6-1-7-27-55)103-73(113)64(101-72(112)63(102-75(115)66(42-25-49-99-79(91)92)107-83(119)123-54-59-34-14-5-15-35-59)37-17-21-45-95-71(111)62(40-23-47-97-77(87)88)105-81(117)121-52-57-30-10-3-11-31-57)38-18-20-43-93-69(109)60(100-74(114)65(41-24-48-98-78(89)90)106-82(118)122-53-58-32-12-4-13-33-58)36-16-19-44-94-70(110)61(39-22-46-96-76(85)86)104-80(116)120-51-56-28-8-2-9-29-56/h1-15,26-35,60-67H,16-25,36-54H2,(H2,84,108)(H,93,109)(H,94,110)(H,95,111)(H,100,114)(H,101,112)(H,102,115)(H,103,113)(H,104,116)(H,105,117)(H,106,118)(H,107,119)(H4,85,86,96)(H4,87,88,97)(H4,89,90,98)(H4,91,92,99)/t60-,61+,62+,63-,64-,65+,66+,67+/m1/s1
InChI key: TVBRKFVKPLYGEM-FQIGNTCESA-N
SMILES: NC(=N)NCCC[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCC[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)OCc1ccccc1)C(=O)NCCCC[C@@H](NC(=O)[C@@H](CCCCNC(=O)[C@H](CCCNC(=N)N)NC(=O)OCc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N
Systematic name  (3):
  • Z-L-Arg-N6-(Z-L-Arg-)D-Lys-N6-[Z-L-Arg-N6-(Z-L-Arg-)D-Lys-]D-Lys-L-Phe-NH2
  • ベンジル N-[(1S)-1-{[(5R)-5-[(2S)-2-{[(ベンジルオキシ)カルボニル]アミノ}-5-カルバムイミドアミドペンタンアミド]-5-{[(5R)-5-[(2R)-2,6-ビス[(2S)-2-{[(ベンジルオキシ)カルボニル]アミノ}-5-カルバムイミドアミドペンタンアミド]ヘキサンアミド]-5-{[(1S)-1-カルバモイル-2-フェニルエチル]カルバモイル}ペンチル]カルバモイル}ペンチル]カルバモイル}-4-カルバムイミドアミドブチル]カルバマート
  • benzyl N-[(1S)-1-{[(5R)-5-[(2S)-2-{[(benzyloxy)carbonyl]amino}-5-carbamimidamidopentanamido]-5-{[(5R)-5-[(2R)-2,6-bis[(2S)-2-{[(benzyloxy)carbonyl]amino}-5-carbamimidamidopentanamido]hexanamido]-5-{[(1S)-1-carbamoyl-2-phenylethyl]carbamoyl}pentyl]carbamoyl}pentyl]carbamoyl}-4-carbamimidamidobutyl]carbamate
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