Chem
J-GLOBAL ID：200907030107264910   Nikkaji number：J2.340.205J

N-[11-(Trimethylaminio)undecanoyl]-L-Leu-L-Leu-L-Leu-L-Glu-OHbis(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)

N-[11-(トリメチルアミニオ)ウンデカノイル]-L-Leu-L-Leu-L-Leu-L-Glu-OHビス(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-ヘプタデカフルオロデシル)
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： C57H76F34N4[N+]O8
Molecular formula furigana： C57-H76-F34-N5-O8
Molecular weight： 1605.207
InChI： InChI=1S/C57H75F34N5O8/c1-29(2)26-33(92-36(97)18-16-14-12-10-11-13-15-17-23-96(7,8)9)38(99)94-35(28-31(5)6)40(101)95-34(27-30(3)4)39(100)93-32(41(102)104-25-22-43(60,61)45(64,65)47(68,69)49(72,73)51(76,77)53(80,81)55(84,85)57(89,90)91)19-20-37(98)103-24-21-42(58,59)44(62,63)46(66,67)48(70,71)50(74,75)52(78,79)54(82,83)56(86,87)88/h29-35H,10-28H2,1-9H3,(H3-,92,93,94,95,97,99,100,101)/p+1/t32-,33-,34-,35-/m0/s1
InChI key： HALKMNWXEAGUSU-BBACVFHCSA-O
SMILES： CC(C)C[C@H](NC(=O)CCCCCCCCCC[N+](C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
Systematic name  (3)：
  • N-[11-(トリメチルアミニオ)ウンデカノイル]-L-Leu-L-Leu-L-Leu-L-Glu-OHビス(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-ヘプタデカフルオロデシル)
  • (10-{[(1S)-1-{[(1S)-1-{[(1S)-1-{[(2S)-1,5-ビス[(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-ヘプタデカフルオロデシル)オキシ]-1,5-ジオキソペンタン-2-イル]カルバモイル}-3-メチルブチル]カルバモイル}-3-メチルブチル]カルバモイル}-3-メチルブチル]カルバモイル}デシル)トリメチルアザニウム
  • (10-{[(1S)-1-{[(1S)-1-{[(1S)-1-{[(2S)-1,5-bis[(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)oxy]-1,5-dioxopentan-2-yl]carbamoyl}-3-methylbutyl]carbamoyl}-3-methylbutyl]carbamoyl}-3-methylbutyl]carbamoyl}decyl)trimethylazanium
Other name (1)：
  • N-[11-(Trimethylaminio)undecanoyl]-L-Leu-L-Leu-L-Leu-L-Glu-OHbis(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)
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