CHEBI:159084 - Arg-Leu-Asp

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Arg-Leu-Asp
ChEBI ID CHEBI:159084
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H30N6O6
Net Charge 0
Average Mass 402.452
Monoisotopic Mass 402.22268
InChI InChI=1S/C16H30N6O6/c1-8(2)6-10(14(26)22-11(15(27)28)7-12(23)24)21-13(25)9(17)4-3-5-20-16(18)19/h8-11H,3-7,17H2,1-2H3,(H,21,25)(H,22,26)(H,23,24)(H,27,28)(H4,18,19,20)/t9-,10-,11-/m0/s1
InChIKey YKZJPIPFKGYHKY-DCAQKATOSA-N
SMILES O=C(N[C@@H](CC(O)=O)C(O)=O)[C@@H](NC(=O)[C@@H](N)CCCN=C(N)N)CC(C)C
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 Arg-Leu-Asp (CHEBI:159084) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylpentanoyl]amino]butanedioic acid