CHEBI:85716 - 3-[(2-aminoethyl)thio]-1-azabicyclo[3.2.0]heptan-7-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[(2-aminoethyl)thio]-1-azabicyclo[3.2.0]heptan-7-one
ChEBI ID CHEBI:85716
Definition A member of the class of azabicycloalkanes that is 1-azabicyclo[3.2.0]heptan-7-one substituted at position 3 by a (2-aminoethyl)thio group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Gemma Holliday
Supplier Information
Download Molfile XML SDF
Formula C8H14N2OS
Net Charge 0
Average Mass 186.27500
Monoisotopic Mass 186.08268
InChI InChI=1S/C8H14N2OS/c9-1-2-12-7-3-6-4-8(11)10(6)5-7/h6-7H,1-5,9H2
InChIKey XUDBEWBIFKREBQ-UHFFFAOYSA-N
SMILES NCCSC1CC2CC(=O)N2C1
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3-[(2-aminoethyl)thio]-1-azabicyclo[3.2.0]heptan-7-one (CHEBI:85716) is a β-lactam (CHEBI:35627)
3-[(2-aminoethyl)thio]-1-azabicyclo[3.2.0]heptan-7-one (CHEBI:85716) is a aliphatic sulfide (CHEBI:22327)
3-[(2-aminoethyl)thio]-1-azabicyclo[3.2.0]heptan-7-one (CHEBI:85716) is a azabicycloalkane (CHEBI:38295)
3-[(2-aminoethyl)thio]-1-azabicyclo[3.2.0]heptan-7-one (CHEBI:85716) is a primary amino compound (CHEBI:50994)
IUPAC Name
3-[(2-aminoethyl)sulfanyl]-1-azabicyclo[3.2.0]heptan-7-one
Citation Waiting for Citations Type Source
21263049 PubMed citation SUBMITTER
Last Modified
08 June 2015