CHEBI:100877 - LSM-12251

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-12251
ChEBI ID CHEBI:100877
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H25N5O3
Net Charge 0
Average Mass 395.456
Monoisotopic Mass 395.19574
InChI InChI=1S/C21H25N5O3/c27-11-15-17-10-25-16(2-1-3-18(25)28)20(26(17)9-13-4-5-13)19(15)21(29)23-8-14-6-7-22-12-24-14/h1-3,6-7,12-13,15,17,19-20,27H,4-5,8-11H2,(H,23,29)/t15-,17-,19+,20+/m1/s1
InChIKey QFGPTMNHKNKAJU-BEKAIBRUSA-N
SMILES C1CC1CN2[C@@H]3CN4C(=O)C=CC=C4[C@H]2[C@H]([C@@H]3CO)C(=O)NCC5=NC=NC=C5
ChEBI Ontology
Outgoing LSM-12251 (CHEBI:100877) is a pyrrolidinecarboxamide (CHEBI:46770)
Manual Xref Database
LSM-12251 LINCS
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