Chem
J-GLOBAL ID：200907076794473265   Nikkaji number：J2.644.497G

L-Ile-L-Ile-L-Ile-L-Ile-L-Ser-L-Cys-L-Ile-Gly-OH

L-Ile-L-Ile-L-Ile-L-Ile-L-Ser-L-Cys-L-Ile-Gly-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： C38H70N8O10S
Molecular formula furigana： C38-H70-N8-O10-S
Molecular weight： 831.080
InChI： InChI=1S/C38H70N8O10S/c1-11-19(6)27(39)34(52)44-30(22(9)14-4)37(55)46-31(23(10)15-5)38(56)45-29(21(8)13-3)36(54)41-24(17-47)32(50)42-25(18-57)33(51)43-28(20(7)12-2)35(53)40-16-26(48)49/h19-25,27-31,47,57H,11-18,39H2,1-10H3,(H,40,53)(H,41,54)(H,42,50)(H,43,51)(H,44,52)(H,45,56)(H,46,55)(H,48,49)/t19-,20-,21-,22-,23-,24-,25-,27-,28-,29-,30-,31-/m0/s1
InChI key： ZZDJXWDVDCYGFO-BHANOTNESA-N
SMILES： CC[C@H](C)[C@H](N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)O
Systematic name  (3)：
  • L-Ile-L-Ile-L-Ile-L-Ile-L-Ser-L-Cys-L-Ile-Gly-OH
  • 2-[(2S,3S)-2-[(2R)-2-[(2S)-2-[(2S,3S)-2-[(2S,3S)-2-[(2S,3S)-2-[(2S,3S)-2-アミノ-3-メチルペンタンアミド]-3-メチルペンタンアミド]-3-メチルペンタンアミド]-3-メチルペンタンアミド]-3-ヒドロキシプロパンアミド]-3-スルファニルプロパンアミド]-3-メチルペンタンアミド]酢酸
  • 2-[(2S,3S)-2-[(2R)-2-[(2S)-2-[(2S,3S)-2-[(2S,3S)-2-[(2S,3S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-methylpentanamido]-3-methylpentanamido]-3-methylpentanamido]-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-methylpentanamido]acetic acid
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