CHEBI:121837 - LSM-33280

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ChEBI Name LSM-33280
ChEBI ID CHEBI:121837
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C26H21N3O5S2
Net Charge 0
Average Mass 519.595
Monoisotopic Mass 519.09226
InChI InChI=1S/C26H21N3O5S2/c1-34-25(33)13-4-6-16(7-5-13)27-20(30)12-35-26-28-18-9-8-17(11-19(18)36-26)29-23(31)21-14-2-3-15(10-14)22(21)24(29)32/h2-9,11,14-15,21-22H,10,12H2,1H3,(H,27,30)
InChIKey XLIZSNQPHLLULU-UHFFFAOYSA-N
SMILES COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)N4C(=O)C5C6CC(C5C4=O)C=C6
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-33280 (CHEBI:121837) is a amidobenzoic acid (CHEBI:48470)
Manual Xref Database
LSM-33280 LINCS
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