CHEBI:91945 - LSM-1888

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ChEBI Name LSM-1888
ChEBI ID CHEBI:91945
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H24N2O4
Net Charge 0
Average Mass 392.449
Monoisotopic Mass 392.17361
InChI InChI=1S/C23H24N2O4/c1-4-28-23(26)20-13(2)24-18-7-8-19-17(21(18)20)12-25-10-9-14-11-15(27-3)5-6-16(14)22(25)29-19/h5-8,11,22,24H,4,9-10,12H2,1-3H3
InChIKey VDDUJINYXKGZLV-UHFFFAOYSA-N
SMILES CCOC(=O)C1=C(NC2=C1C3=C(C=C2)OC4C5=C(CCN4C3)C=C(C=C5)OC)C
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing LSM-1888 (CHEBI:91945) is a indolyl carboxylic acid (CHEBI:46867)
Manual Xref Database
LSM-1888 LINCS
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