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Home > Encyclopedia > L-Valine,N-[N-[2,4,5-trideoxy-4-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-5-phenyl-L-threo-pentonoyl]-L-valyl]-,methyl ester (9CI)

L-Valine,N-[N-[2,4,5-trideoxy-4-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-5-phenyl-L-threo-pentonoyl]-L-valyl]-,methyl ester (9CI)

L-Valine,N-[N-[2,4,5-trideoxy-4-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-5-phenyl-L-threo-pentonoyl]-L-valyl]-,methyl ester (9CI) structure

L-Valine,N-[N-[2,4,5-trideoxy-4-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-5-phenyl-L-threo-pentonoyl]-L-valyl]-,methyl ester (9CI) 

structure
  • CAS No:

    126333-31-1

  • Formula:

    C37H60N6O11

  • Chemical Name:

    L-Valine,N-[N-[2,4,5-trideoxy-4-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-5-phenyl-L-threo-pentonoyl]-L-valyl]-,methyl ester (9CI)

  • Synonyms:

    Boc-SAA-I-VV-OMe;126333-31-1;(S)-2-((S)-2-((3S,4S)-4-(((S)-2-((S)-2-((S)-2-tert-Butoxycarbonylamino-3-hydroxy-propanoylamino)-propanoylamino)-propanoyl)-methyl-amino)-3-hydroxy-5-phenyl-pentanoylamino)-3-methyl-butanoylamino)-3-methyl-butyric acid methyl ester;(S)-2-{(S)-2-[(3S,4S)-4-({(S)-2-[(S)-2-((S)-2-tert-Butoxycarbonylamino-3-hydroxy-propanoylamino)-propanoylamino]-propanoyl}-methyl-amino)-3-hydroxy-5-phenyl-pentanoylamino]-3-methyl-butanoylamino}-3-methyl-butyric acid methyl ester;Statine analog (Boc-SAA-I-VV-OMe);methyl (2S)-2-[[(2S)-2-[[(3S,4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-(tert-butoxycarbonylamino)-3-hydroxy-propanoyl]amino]propanoyl]amino]propanoyl]-methyl-amino]-3-hydroxy-5-phenyl-pentanoyl]amino]-3-methyl-butanoyl]amino]-3-methyl-butanoate

L-Valine,N-[N-[2,4,5-trideoxy-4-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-5-phenyl-L-threo-pentonoyl]-L-valyl]-,methyl ester (9CI) Basic Attributes

764.9 g/mol

764.43200675 g/mol

Characteristics

242 Ų

Computed Properties

Molecular Weight:764.9
XLogP3:2
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:22
Exact Mass:764.43200675
Monoisotopic Mass:764.43200675
Topological Polar Surface Area:242
Heavy Atom Count:54
Complexity:1280
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of L-Valine,N-[N-[2,4,5-trideoxy-4-[[N-[N-[N-[(1,1-dimethylethoxy)carbonyl]-L-seryl]-L-alanyl]-L-alanyl]amino]-5-phenyl-L-threo-pentonoyl]-L-valyl]-,methyl ester (9CI)

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