BMRB

Biological Magnetic Resonance Data Bank


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

Procyclidine

Graphical representations:

Procyclidine image

Molecular Formula: C19 H29 N O

Natural Isotopic Abundance Mass: 287.43966

Mono-Isotopic Molecular Masses:

  • C12N14: 287.2249145582
  • C13N14: 306.2886564764
  • C12N15: 288.2219494514
  • C13N15: 307.2856913696

InCHi String: InChI=1S/C19H29NO/c21-19(17-9-3-1-4-10-17,18-11-5-2-6-12-18)13-16-20-14-7-8-15-20/h1,3-4,9-10,18,21H,2,5-8,11-16H2

canonical and isomeric SMILES: C1CCC(CC1)C(CCN2CCCC2)(C3=CC=CC=C3)O

PUBCHEM iupac NAME
1-cyclohexyl-1-phenyl-3-pyrrolidin-1-ylpropan-1-ol

PUBCHEM iupac TRADITIONAL NAME
1-cyclohexyl-1-phenyl-3-pyrrolidino-propan-1-ol

PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac SYSTEMATIC NAME
1-cyclohexyl-1-phenyl-3-pyrrolidin-1-yl-propan-1-ol

PUBCHEM iupac CAS NAME
1-cyclohexyl-1-phenyl-3-(1-pyrrolidinyl)-1-propanol

PubChem Substance (SID):   149436   9582   10365753
PubChem Compound (CID):   4919
KEGG: Compound ID   C07378
CAS Registry IDs:   56172-67-9   77-37-2   107661-03-0
PDB Chemical Component   n/a
Miscellaneous Databases and IDs:   CAS 77-37-2   MMCD cq_04370   EINECS 201-023-0   Beilstein Handbook Reference 5-20-01-00250   ChemIDplus 000077372   NIST Chemistry WebBook 264206997   NIST 264206997

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.