CHEBI:3258 - CB3717

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ChEBI Name CB3717
ChEBI ID CHEBI:3258
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C24H23N5O6
Net Charge 0
Average Mass 477.470
Monoisotopic Mass 477.16483
InChI InChI=1S/C24H23N5O6/c1-2-11-29(13-14-3-8-18-17(12-14)22(33)28-24(25)27-18)16-6-4-15(5-7-16)21(32)26-19(23(34)35)9-10-20(30)31/h1,3-8,12,19H,9-11,13H2,(H,26,32)(H,30,31)(H,34,35)(H3,25,27,28,33)/t19-/m0/s1
InChIKey LTKHPMDRMUCUEB-IBGZPJMESA-N
SMILES Nc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cc2c(=O)[nH]1
Roles Classification
Chemical Role(s): 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 CB3717 (CHEBI:3258) is a N-acyl-L-glutamic acid (CHEBI:21650)
Synonym Source
CB3717 KEGG COMPOUND
Manual Xrefs Databases
C11737 KEGG COMPOUND
CB3 PDBeChem
View more database links
Last Modified
03 December 2014