CHEBI:103209 - LSM-14554

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ChEBI Name LSM-14554
ChEBI ID CHEBI:103209
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C34H40N4O5
Net Charge 0
Average Mass 584.706
Monoisotopic Mass 584.29987
InChI InChI=1S/C34H40N4O5/c1-22-18-38(23(2)20-39)33(40)32-31(28-15-8-9-16-29(28)37(32)4)27-14-7-6-11-24(27)21-43-30(22)19-36(3)34(41)35-25-12-10-13-26(17-25)42-5/h6-17,22-23,30,39H,18-21H2,1-5H3,(H,35,41)/t22-,23+,30+/m0/s1
InChIKey FNKQMQRSMOAQIH-DDFCPOBKSA-N
SMILES C[C@H]1CN(C(=O)C2=C(C3=CC=CC=C3CO[C@@H]1CN(C)C(=O)NC4=CC(=CC=C4)OC)C5=CC=CC=C5N2C)[C@H](C)CO
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-14554 (CHEBI:103209) is a indolyl carboxylic acid (CHEBI:46867)
Manual Xref Database
LSM-14554 LINCS
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