CHEBI:37628 - desmosine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name desmosine
ChEBI ID CHEBI:37628
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information eMolecules:31230051, ZINC000035024527
Download Molfile XML SDF
Formula C24H40N5O8
Net Charge +1
Average Mass 526.60330
Monoisotopic Mass 526.28714
InChI InChI=1S/C24H39N5O8/c25-17(21(30)31)5-1-2-11-29-12-14(7-9-19(27)23(34)35)16(4-3-6-18(26)22(32)33)15(13-29)8-10-20(28)24(36)37/h12-13,17-20H,1-11,25-28H2,(H3-,30,31,32,33,34,35,36,37)/p+1/t17-,18-,19-,20-/m0/s1
InChIKey VEVRNHHLCPGNDU-MUGJNUQGSA-O
SMILES N[C@@H](CCCC[n+]1cc(CC[C@H](N)C(O)=O)c(CCC[C@H](N)C(O)=O)c(CC[C@H](N)C(O)=O)c1)C(O)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing desmosine (CHEBI:37628) has functional parent L-lysine (CHEBI:18019)
desmosine (CHEBI:37628) is a aromatic amino acid (CHEBI:33856)
Incoming desmosine residue (CHEBI:37629) is substituent group from desmosine (CHEBI:37628)
IUPAC Name
4-[(4S)-4-amino-4-carboxybutyl]-1-[(5S)-5-amino-5-carboxypentyl]-3,5-bis[(3S)-3-amino-3-carboxypropyl]pyridinium
Synonym Source
Des ChEBI
Registry Numbers Types Sources
11003-57-9 CAS Registry Number ChemIDplus
4074277 Beilstein Registry Number Beilstein
Last Modified
23 October 2015