Chem
J-GLOBAL ID：200907076878343154   Nikkaji number：J1.184.462F

EAKA16-I

L-Ala-L-Glu-L-Ala-L-Lys-L-Ala-L-Glu-L-Ala-L-Lys-L-Ala-L-Glu-L-Ala-L-Lys-L-Ala-L-Glu-L-Ala-L-Lys-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： C68H118N20O25
Molecular formula furigana： C68-H118-N20-O25
Molecular weight： 1615.807
InChI： InChI=1S/C68H118N20O25/c1-33(73)53(97)81-44(21-25-49(89)90)64(108)77-34(2)54(98)82-41(17-9-13-29-69)61(105)74-37(5)57(101)85-45(22-26-50(91)92)65(109)78-35(3)55(99)83-42(18-10-14-30-70)62(106)75-38(6)58(102)86-46(23-27-51(93)94)66(110)79-36(4)56(100)84-43(19-11-15-31-71)63(107)76-39(7)59(103)87-47(24-28-52(95)96)67(111)80-40(8)60(104)88-48(68(112)113)20-12-16-32-72/h33-48H,9-32,69-73H2,1-8H3,(H,74,105)(H,75,106)(H,76,107)(H,77,108)(H,78,109)(H,79,110)(H,80,111)(H,81,97)(H,82,98)(H,83,99)(H,84,100)(H,85,101)(H,86,102)(H,87,103)(H,88,104)(H,89,90)(H,91,92)(H,93,94)(H,95,96)(H,112,113)/t33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-/m0/s1
InChI key： LNPDOYSHCIZTOG-BAVVLCHISA-N
SMILES： C[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O
Systematic name  (3)：
  • L-Ala-L-Glu-L-Ala-L-Lys-L-Ala-L-Glu-L-Ala-L-Lys-L-Ala-L-Glu-L-Ala-L-Lys-L-Ala-L-Glu-L-Ala-L-Lys-OH
  • (2S)-6-アミノ-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-アミノ-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-アミノ-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-アミノ-2-[(2S)-2-[(2S)-2-[(2S)-2-アミノプロパンアミド]-4-カルボキシブタンアミド]プロパンアミド]ヘキサンアミド]プロパンアミド]-4-カルボキシブタンアミド]プロパンアミド]ヘキサンアミド]プロパンアミド]-4-カルボキシブタンアミド]プロパンアミド]ヘキサンアミド]プロパンアミド]-4-カルボキシブタンアミド]プロパンアミド]ヘキサン酸
  • (2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-carboxybutanamido]propanamido]hexanamido]propanamido]-4-carboxybutanamido]propanamido]hexanamido]propanamido]-4-carboxybutanamido]propanamido]hexanamido]propanamido]-4-carboxybutanamido]propanamido]hexanoic acid
Other name (1)：
  • EAKA16-I
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