Chem
J-GLOBAL ID:200907097096927413   Nikkaji number:J1.650.988D

(3S)-N-Isobutyl-3-[[(2S)-2-(tert-butyloxycarbonylamino)-4-methylpentanoyl]amino]succinamidic acid

(3S)-N-イソブチル-3-[[(2S)-2-(tert-ブチルオキシカルボニルアミノ)-4-メチルペンタノイル]アミノ]スクシンアミド酸
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: C19H35N3O6
Molecular formula furigana: C19-H35-N3-O6
Molecular weight: 401.504
InChI: InChI=1S/C19H35N3O6/c1-11(2)8-13(22-18(27)28-19(5,6)7)17(26)21-14(9-15(23)24)16(25)20-10-12(3)4/h11-14H,8-10H2,1-7H3,(H,20,25)(H,21,26)(H,22,27)(H,23,24)/t13-,14-/m0/s1
InChI key: LMPUNIMNVIEXCT-KBPBESRZSA-N
SMILES: CC(C)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C
Systematic name  (3):
  • (3S)-N-イソブチル-3-[[(2S)-2-(tert-ブチルオキシカルボニルアミノ)-4-メチルペンタノイル]アミノ]スクシンアミド酸
  • (3S)-3-[(2S)-2-{[(tert-ブトキシ)カルボニル]アミノ}-4-メチルペンタンアミド]-3-[(2-メチルプロピル)カルバモイル]プロパン酸
  • (3S)-3-[(2S)-2-{[(tert-butoxy)carbonyl]amino}-4-methylpentanamido]-3-[(2-methylpropyl)carbamoyl]propanoic acid
Other name (1):
  • (3S)-N-Isobutyl-3-[[(2S)-2-(tert-butyloxycarbonylamino)-4-methylpentanoyl]amino]succinamidic acid
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