Cas no 38495-84-0 ((2S,2'S)-Pyrosaccharopine)

(2S,2'S)-Pyrosaccharopine structure
(2S,2'S)-Pyrosaccharopine structure
Product Name:(2S,2'S)-Pyrosaccharopine
CAS No:38495-84-0
MF:C11H18N2O5
MW:258.271023273468
CID:2081357
PubChem ID:131752421
Update Time:2025-04-21

(2S,2'S)-Pyrosaccharopine Chemical and Physical Properties

Names and Identifiers

    • (2S,2'S)-Pyrosaccharopine
    • 5-Oxo-1-(5-amino-5-carboxy-pentyl)-pyrrolidin-carbonsaeure-(2)
    • Pyrosaccharopin
    • Pyrosaccharopine
    • Saccharopine lactam
    • Saccharopin-Lactam
    • UNII-OUN2F25T6S
    • 1-Pyrrolidinehexanoic acid, alpha-amino-2-carboxy-5-oxo-
    • L-Pyrosaccharopine
    • 1-PYRROLIDINEHEXANOIC ACID, .ALPHA.-AMINO-2-CARBOXY-5-OXO-
    • DTXSID201166106
    • 1-Pyrrolidinehexanoic acid, alpha-amino-2-carboxy-5-oxo-, [S-(R*,R*)]-
    • OUN2F25T6S
    • (S)-1-((S)-5-Amino-5-carboxypentyl)-5-oxopyrrolidine-2-carboxylic acid
    • 38495-84-0
    • CHEBI:173839
    • 1-(5-AMINO-5-CARBOXYPENTYL)-5-OXOPYRROLIDINE-2-CARBOXYLIC ACID
    • 1-Pyrrolidinehexanoic acid, I+/--amino-2-carboxy-5-oxo-, [S-(R*,R*)]-
    • Inchi: 1S/C11H18N2O5/c12-7(10(15)16)3-1-2-6-13-8(11(17)18)4-5-9(13)14/h7-8H,1-6,12H2,(H,15,16)(H,17,18)/t7-,8-/m0/s1
    • InChI Key: KZGLERZNBKMMPP-YUMQZZPRSA-N
    • SMILES: O=C1CC[C@@H](C(=O)O)N1CCCC[C@@H](C(=O)O)N

Computed Properties

  • Exact Mass: 258.12157168g/mol
  • Monoisotopic Mass: 258.12157168g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 7
  • Complexity: 344
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -3.1
  • Topological Polar Surface Area: 121?2
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