Chem
J-GLOBAL ID：200907044859920869   Nikkaji number：J357.361C

(3S,4S)-4-[(Isovaleryl-L-Val-L-Val-)amino]-3-hydroxy-6-methylheptanoic acid ethyl ester

(3S,4S)-4-[(イソバレリル-L-Val-L-Val-)アミノ]-3-ヒドロキシ-6-メチルヘプタン酸エチル
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： C25H47N3O6
Molecular formula furigana： C25-H47-N3-O6
Molecular weight： 485.666
InChI： InChI=1S/C25H47N3O6/c1-10-34-21(31)13-19(29)18(11-14(2)3)26-24(32)23(17(8)9)28-25(33)22(16(6)7)27-20(30)12-15(4)5/h14-19,22-23,29H,10-13H2,1-9H3,(H,26,32)(H,27,30)(H,28,33)/t18-,19-,22-,23-/m0/s1
InChI key： SMVMSLPPAGGLDL-ZZTDLJEGSA-N
SMILES： CCOC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C
Systematic name  (4)：
  • (3S,4S)-4-[(イソバレリル-L-Val-L-Val-)アミノ]-3-ヒドロキシ-6-メチルヘプタン酸エチル
  • (3S,4S)-3-ヒドロキシ-4-[[N-(3-メチルブチリル)-Val-Val-]アミノ]-6-メチルヘプタン酸エチル
  • エチル (3S,4S)-3-ヒドロキシ-6-メチル-4-[(2S)-3-メチル-2-[(2S)-3-メチル-2-(3-メチルブタンアミド)ブタンアミド]ブタンアミド]ヘプタノアート
  • ethyl (3S,4S)-3-hydroxy-6-methyl-4-[(2S)-3-methyl-2-[(2S)-3-methyl-2-(3-methylbutanamido)butanamido]butanamido]heptanoate
Other name (2)：
  • (3S,4S)-4-[(Isovaleryl-L-Val-L-Val-)amino]-3-hydroxy-6-methylheptanoic acid ethyl ester
  • (3S,4S)-3-Hydroxy-4-[[N-(3-methylbutyryl)-Val-Val-]amino]-6-methylheptanoic acid ethyl ester
Thsaurus map：
Thesaurus Map

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