CHEBI:63487 - 1,3,6,8-tetraazatricyclo[6.2.1.13,6]dodecane

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1,3,6,8-tetraazatricyclo[6.2.1.13,6]dodecane
ChEBI ID CHEBI:63487
ChEBI ASCII Name 1,3,6,8-tetraazatricyclo[6.2.1.1(3,6)]dodecane
Definition An azatricycloalkane that is tricyclo[6.2.1.13,6]dodecane in which the four bridgehead CH groups are replaced by nitrogen atoms. It is a small-molecule BAX agonist.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C8H16N4
Net Charge 0
Average Mass 168.23940
Monoisotopic Mass 168.13750
InChI InChI=1S/C8H16N4/c1-2-10-5-9(1)7-11-3-4-12(6-11)8-10/h1-8H2
InChIKey ZBFHXDNNFOOFLY-UHFFFAOYSA-N
SMILES C1CN2CN1CN1CCN(C2)C1
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): apoptosis inducer
Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1,3,6,8-tetraazatricyclo[6.2.1.13,6]dodecane (CHEBI:63487) has role antineoplastic agent (CHEBI:35610)
1,3,6,8-tetraazatricyclo[6.2.1.13,6]dodecane (CHEBI:63487) has role apoptosis inducer (CHEBI:68495)
1,3,6,8-tetraazatricyclo[6.2.1.13,6]dodecane (CHEBI:63487) is a azatricycloalkane (CHEBI:63489)
1,3,6,8-tetraazatricyclo[6.2.1.13,6]dodecane (CHEBI:63487) is a bridged compound (CHEBI:35990)
1,3,6,8-tetraazatricyclo[6.2.1.13,6]dodecane (CHEBI:63487) is a tetramine (CHEBI:39166)
IUPAC Name
1,3,6,8-tetraazatricyclo[6.2.1.13,6]dodecane
Synonyms Sources
1,3,6,8-diendomethylene-1,3,6,8-tetraazacyclodecane ChEBI
1,3,6,8-tetraazatricyclo[6.2.1.1(3,6)]dodecane ChEBI
1,3,6,8-tetraazatricyclo[6.2.1.13,6]dodecane ChemIDplus
NSC 4436 ChemIDplus
SMBA2 ChEBI
Brand Name Source
Dimtac ChEBI
Manual Xrefs Databases
79001 ChemSpider
EP3289011 Patent
View more database links
Registry Numbers Types Sources
18304-79-5 CAS Registry Number ChemIDplus
281-86-7 CAS Registry Number ChemIDplus
606681 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
22043012 PubMed citation Europe PMC
25230299 PubMed citation Europe PMC
Last Modified
13 May 2021