CHEBI:15742 - pseudotropine

ChEBI IDCHEBI:15742
ChEBI Namepseudotropine
Stars
Secondary ChEBI IDsCHEBI:8609, CHEBI:14963, CHEBI:26363, CHEBI:45199
Last Modified27 January 2016
DownloadsMolfile
FormulaC8H15NO
Net Charge0
Average Mass141.214
Monoisotopic Mass141.11536
SMILESCN1[C@@H]2CC[C@H]1C[C@H](O)C2
InChIInChI=1S/C8H15NO/c1-9-6-2-3-7(9)5-8(10)4-6/h6-8,10H,2-5H2,1H3/t6-,7+,8-
InChIKeyCYHOMWAPJJPNMW-RNLVFQAGSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
pseudotropine (CHEBI:15742) has role mouse metabolite (CHEBI:75771)
pseudotropine (CHEBI:15742) is a tropane alkaloid (CHEBI:37332)
pseudotropine (CHEBI:15742) is conjugate base of pseudotropinium (CHEBI:57493)
Incoming Relation(s)
O-acylpseudotropine (CHEBI:52657) has functional parent pseudotropine (CHEBI:15742)
pseudotropinium (CHEBI:57493) is conjugate acid of pseudotropine (CHEBI:15742)
IUPAC Name 
tropan-3β-ol
Synonyms  Source
PseudotropineKEGG COMPOUND
exo-8-methyl-8-azabicyclo[3.2.1]octan-3-olNIST Chemistry WebBook
H,5αH-tropan-3β-olNIST Chemistry WebBook
3β-tropanolNIST Chemistry WebBook
pseudotropanolNIST Chemistry WebBook
3-pseudotropanolChemIDplus
Manual XrefsDatabases
C02066KEGG COMPOUND
PTOPDBeChem
DB04026DrugBank
C00002301KNApSAcK
Registry NumbersSources
Beilstein:80189Beilstein
CAS:135-97-7KEGG COMPOUND
CAS:135-97-7ChemIDplus
CAS:135-97-7NIST Chemistry WebBook