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> Main
CHEBI:37391 - 1,4,7,10-tetraazacyclododecane
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ChEBI Ontology
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ChEBI Name
1,4,7,10-tetraazacyclododecane
ChEBI ID
CHEBI:37391
Definition
An azacycloalkane that is cyclododecane in which the carbon atoms at positions 1, 4, 7 and 10 are replaced by nitrogen atoms.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C8H20N4
Net Charge
0
Average Mass
172.276
Monoisotopic Mass
172.16880
InChI
InChI=1S/C8H20N4/c1-2-10-5-6-12-8-7-11-4-3-9-1/h9-12H,1-8H2
InChIKey
QBPPRVHXOZRESW-UHFFFAOYSA-N
SMILES
C1CNCCNCCNCCN1
ChEBI Ontology
Outgoing
1,4,7,10-tetraazacyclododecane (
CHEBI:37391
)
is a
azacycloalkane (
CHEBI:37949
)
1,4,7,10-tetraazacyclododecane (
CHEBI:37391
)
is a
crown amine (
CHEBI:37411
)
1,4,7,10-tetraazacyclododecane (
CHEBI:37391
)
is a
saturated organic heteromonocyclic parent (
CHEBI:36389
)
Incoming
DOTA (
CHEBI:61028
)
has parent hydride
1,4,7,10-tetraazacyclododecane (
CHEBI:37391
)
H
3
HP-DO3A (
CHEBI:37387
)
has parent hydride
1,4,7,10-tetraazacyclododecane (
CHEBI:37391
)
IUPAC Name
1,4,7,10-tetraazacyclododecane
Synonyms
Sources
[12]aneN
4
IUPAC
cyclen
ChemIDplus
Manual Xref
Database
YCN
PDBeChem
View more database links
Registry Numbers
Types
Sources
294-90-6
CAS Registry Number
ChemIDplus
50235
Gmelin Registry Number
Gmelin
606114
Beilstein Registry Number
Beilstein
Citations
Types
Sources
10927382
PubMed citation
Europe PMC
18261472
PubMed citation
Europe PMC
20401883
PubMed citation
Europe PMC
23034678
PubMed citation
Europe PMC
25033801
PubMed citation
Europe PMC
26244894
PubMed citation
Europe PMC
27150477
PubMed citation
Europe PMC
29712202
PubMed citation
Europe PMC
30366101
PubMed citation
Europe PMC
31062805
PubMed citation
Europe PMC
32254732
PubMed citation
Europe PMC
32658468
PubMed citation
Europe PMC
33592771
PubMed citation
Europe PMC
33689299
PubMed citation
Europe PMC
Last Modified
16 April 2021