Chem
J-GLOBAL ID：200907004751865339   Nikkaji number：J1.807.620I

Immunex compound 1

イムネックス化合物1
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： C19H37N5O5
Molecular formula furigana： C19-H37-N5-O5
Molecular weight： 415.535
InChI： InChI=1S/C19H37N5O5/c1-11(2)9-13(10-14(25)24-29)17(27)23-15(19(4,5)6)18(28)22-12(3)16(26)21-8-7-20/h11-13,15,29H,7-10,20H2,1-6H3,(H,21,26)(H,22,28)(H,23,27)(H,24,25)/t12-,13+,15+/m0/s1
InChI key： LMIQCBIEAHJAMZ-GZBFAFLISA-N
SMILES： CC(C)C[C@H](CC(=O)NO)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCCN)C(C)(C)C
Systematic name  (4)：
  • N-[(R)-2-(ヒドロキシカルバモイルメチル)-4-メチルペンタノイル]-3-メチル-L-Val-L-Ala-(2-アミノエチル)NH2
  • N-(2-アミノエチル)-Nα-[(2S)-2-[[(R)-4-(ヒドロキシアミノ)-2-イソブチル-1,4-ジオキソブチル]アミノ]-3,3-ジメチルブチリル]-L-アラニンアミド
  • (2R)-N-[(1S)-1-{[(1S)-1-[(2-アミノエチル)カルバモイル]エチル]カルバモイル}-2,2-ジメチルプロピル]-N'-ヒドロキシ-2-(2-メチルプロピル)ブタンジアミド
  • (2R)-N-[(1S)-1-{[(1S)-1-[(2-aminoethyl)carbamoyl]ethyl]carbamoyl}-2,2-dimethylpropyl]-N'-hydroxy-2-(2-methylpropyl)butanediamide
Other name (4)：
  • N-[(R)-2-(Hydroxycarbamoylmethyl)-4-methylpentanoyl]-3-methyl-L-Val-L-Ala-(2-aminoethyl)NH2
  • N-(2-Aminoethyl)-Nα-[(2S)-2-[[(R)-4-(hydroxyamino)-2-isobutyl-1,4-dioxobutyl]amino]-3,3-dimethylbutyryl]-L-alaninamide
  • イムネックス化合物1
  • Immunex compound 1
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