Chem
J-GLOBAL ID：200907090279926314   Nikkaji number：J2.340.203C

N-[11-(Trimethylaminio)undecanoyl]-L-Ala-L-Ala-L-Ala-L-Glu-OHdidodecyl

N-[11-(トリメチルアミニオ)ウンデカノイル]-L-Ala-L-Ala-L-Ala-L-Glu-OHジドデシル
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： C52H100N4[N+]O8
Molecular formula furigana： C52-H100-N5-O8
Molecular weight： 923.398
InChI： InChI=1S/C52H99N5O8/c1-9-11-13-15-17-19-23-27-31-35-41-64-48(59)39-38-46(52(63)65-42-36-32-28-24-20-18-16-14-12-10-2)56-51(62)45(5)55-50(61)44(4)54-49(60)43(3)53-47(58)37-33-29-25-21-22-26-30-34-40-57(6,7)8/h43-46H,9-42H2,1-8H3,(H3-,53,54,55,56,58,60,61,62)/p+1/t43-,44-,45-,46-/m0/s1
InChI key： USIFRLXTWKFXIW-AXYJRABVSA-O
SMILES： CCCCCCCCCCCCOC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CCCCCCCCCC[N+](C)(C)C)C(=O)OCCCCCCCCCCCC
Systematic name  (3)：
  • N-[11-(トリメチルアミニオ)ウンデカノイル]-L-Ala-L-Ala-L-Ala-L-Glu-OHジドデシル
  • (10-{[(1S)-1-{[(1S)-1-{[(1S)-1-{[(2S)-1,5-ビス(ドデシルオキシ)-1,5-ジオキソペンタン-2-イル]カルバモイル}エチル]カルバモイル}エチル]カルバモイル}エチル]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(dodecyloxy)-1,5-dioxopentan-2-yl]carbamoyl}ethyl]carbamoyl}ethyl]carbamoyl}ethyl]carbamoyl}decyl)trimethylazanium
Other name (1)：
  • N-[11-(Trimethylaminio)undecanoyl]-L-Ala-L-Ala-L-Ala-L-Glu-OHdidodecyl
Thsaurus map：
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