Chem
J-GLOBAL ID:200907068450890573   Nikkaji number:J1.184.480D

DAR16-IV

L-Ala-L-Asp-L-Ala-L-Asp-L-Ala-L-Asp-L-Ala-L-Asp-L-Ala-L-Arg-L-Ala-L-Arg-L-Ala-L-Arg-L-Ala-L-Arg-OH
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: C64H110N28O25
Molecular formula furigana: C64-H110-N28-O25
Molecular weight: 1671.755
InChI: InChI=1S/C64H110N28O25/c1-25(65)45(101)89-37(21-41(93)94)56(112)82-30(6)50(106)91-39(23-43(97)98)58(114)84-32(8)52(108)92-40(24-44(99)100)59(115)83-31(7)51(107)90-38(22-42(95)96)57(113)81-28(4)48(104)87-34(14-10-18-75-62(68)69)54(110)79-26(2)46(102)85-33(13-9-17-74-61(66)67)53(109)78-27(3)47(103)86-35(15-11-19-76-63(70)71)55(111)80-29(5)49(105)88-36(60(116)117)16-12-20-77-64(72)73/h25-40H,9-24,65H2,1-8H3,(H,78,109)(H,79,110)(H,80,111)(H,81,113)(H,82,112)(H,83,115)(H,84,114)(H,85,102)(H,86,103)(H,87,104)(H,88,105)(H,89,101)(H,90,107)(H,91,106)(H,92,108)(H,93,94)(H,95,96)(H,97,98)(H,99,100)(H,116,117)(H4,66,67,74)(H4,68,69,75)(H4,70,71,76)(H4,72,73,77)/t25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-/m0/s1
InChI key: WGUZGNDHBVXNTN-FLFZXROJSA-N
SMILES: C[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O
Systematic name  (3):
  • L-Ala-L-Asp-L-Ala-L-Asp-L-Ala-L-Asp-L-Ala-L-Asp-L-Ala-L-Arg-L-Ala-L-Arg-L-Ala-L-Arg-L-Ala-L-Arg-OH
  • (2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-アミノプロパンアミド]-3-カルボキシプロパンアミド]プロパンアミド]-3-カルボキシプロパンアミド]プロパンアミド]-3-カルボキシプロパンアミド]プロパンアミド]-3-カルボキシプロパンアミド]プロパンアミド]-5-カルバムイミドアミドペンタンアミド]プロパンアミド]-5-カルバムイミドアミドペンタンアミド]プロパンアミド]-5-カルバムイミドアミドペンタンアミド]プロパンアミド]-5-カルバムイミドアミドペンタン酸
  • (2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-carboxypropanamido]propanamido]-3-carboxypropanamido]propanamido]-3-carboxypropanamido]propanamido]-3-carboxypropanamido]propanamido]-5-carbamimidamidopentanamido]propanamido]-5-carbamimidamidopentanamido]propanamido]-5-carbamimidamidopentanamido]propanamido]-5-carbamimidamidopentanoic acid
Other name (1):
  • DAR16-IV
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