BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

Putrescine (1,4 Diaminobutane)

Graphical representations:

Putrescine (1,4 diaminobutane) image

Molecular Formula: C4 H12 N2

Natural Isotopic Abundance Mass: 88.1514800000

Mono-Isotopic Molecular Masses:

  • C12N14: 88.1000483956
  • C13N14: 92.1134677468
  • C12N15: 90.094118182
  • C13N15: 94.1075375332

InCHi String: InChI=1S/C4H12N2/c5-3-1-2-4-6/h1-6H2

isomeric and canonical SMILES: C(CCN)CN

IUPAC
butane-1,4-diamine

PubChem Substance (SID):   85164945   151181   3434
PubChem Compound (CID):   1045
KEGG: Compound ID   C00134
CAS Registry IDs:   110-60-1
PDB Chemical Component   PUT
Miscellaneous Databases and IDs:   CHEBI 17148   EINECS 203-782-3   NSC 60545   Beilstein Handbook Reference 4-04-00-01283   CCRIS 6751

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.