CHEBI:102905 - LSM-14251

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ChEBI Name LSM-14251
ChEBI ID CHEBI:102905
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C32H39N5O5
Net Charge 0
Average Mass 573.684
Monoisotopic Mass 573.29512
InChI InChI=1S/C32H39N5O5/c1-19-15-37(20(2)17-38)31(39)30-28(25-13-9-10-14-26(25)36(30)6)24-12-8-7-11-23(24)18-41-27(19)16-35(5)32(40)33-29-21(3)34-42-22(29)4/h7-14,19-20,27,38H,15-18H2,1-6H3,(H,33,40)/t19-,20+,27+/m0/s1
InChIKey WBCPGODJHKXDGU-ASHZAFPQSA-N
SMILES C[C@H]1CN(C(=O)C2=C(C3=CC=CC=C3CO[C@@H]1CN(C)C(=O)NC4=C(ON=C4C)C)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-14251 (CHEBI:102905) is a indolyl carboxylic acid (CHEBI:46867)
Manual Xref Database
LSM-14251 LINCS
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