CHEBI:100529 - LSM-11903

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ChEBI Name LSM-11903
ChEBI ID CHEBI:100529
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C28H26N2O6
Net Charge 0
Average Mass 486.517
Monoisotopic Mass 486.17909
InChI InChI=1S/C28H26N2O6/c31-15-21-20-14-29-22(10-9-19(27(29)32)8-6-17-4-2-1-3-5-17)25(20)30(26(21)28(33)34)13-18-7-11-23-24(12-18)36-16-35-23/h1-12,20-21,25-26,31H,13-16H2,(H,33,34)/t20-,21-,25+,26-/m0/s1
InChIKey JUBZNFCZFZOAAP-MSNAGZIKSA-N
SMILES C1[C@H]2[C@@H]([C@H](N([C@H]2C3=CC=C(C(=O)N31)C=CC4=CC=CC=C4)CC5=CC6=C(C=C5)OCO6)C(=O)O)CO
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 )
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via L-alpha-amino acid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing LSM-11903 (CHEBI:100529) is a L-α-amino acid (CHEBI:15705)
Manual Xref Database
LSM-11903 LINCS
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