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Home > Encyclopedia > (2S,3aS,7aS)-1-[(4R)-4-carboxy-4-(phenylmethoxycarbonylamino)butanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid

(2S,3aS,7aS)-1-[(4R)-4-carboxy-4-(phenylmethoxycarbonylamino)butanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid

(2S,3aS,7aS)-1-[(4R)-4-carboxy-4-(phenylmethoxycarbonylamino)butanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid structure

(2S,3aS,7aS)-1-[(4R)-4-carboxy-4-(phenylmethoxycarbonylamino)butanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid 

structure
  • CAS No:

    97975-46-7

  • Formula:

    C22H28N2O7

  • Chemical Name:

    (2S,3aS,7aS)-1-[(4R)-4-carboxy-4-(phenylmethoxycarbonylamino)butanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid

  • Synonyms:

    1-(N-carbobenzoxy-gamma-glutamyl)perhydroindoline-2-carboxylic acid;1-CGPIC;CHEMBL40435;1-Cgpic;1-(N-Carbobenzoxy-gamma-glutamyl)perhydroindoline-2-carboxylic acid;BDBM50021184;1-(4-Benzyloxycarbonylamino-4-carboxy-butyryl)-octahydro-indole-2-carboxylic acid;1H-Indole-1-pentanoic acid, 2-carboxyoctahydro-delta-oxo-alpha-(((phenylmethoxy)carbonyl)amino)-, (2S-(1(S*),2apha,3abeta,7abeta))-;97975-46-7

(2S,3aS,7aS)-1-[(4R)-4-carboxy-4-(phenylmethoxycarbonylamino)butanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid Basic Attributes

432.5 g/mol

432.18965124 g/mol

Characteristics

133 Ų

Drug Information

1-(N-carbobenzoxy-gamma-glutamyl)perhydroindoline-2-carboxylic acid

Computed Properties

Molecular Weight:432.5
XLogP3:2.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:432.18965124
Monoisotopic Mass:432.18965124
Topological Polar Surface Area:133
Heavy Atom Count:31
Complexity:677
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of (2S,3aS,7aS)-1-[(4R)-4-carboxy-4-(phenylmethoxycarbonylamino)butanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid

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