CHEBI:102730 - LSM-14076

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-14076
ChEBI ID CHEBI:102730
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H25N3O5S
Net Charge 0
Average Mass 431.507
Monoisotopic Mass 431.15149
InChI InChI=1S/C21H25N3O5S/c1-13-6-4-7-14(10-13)30(28,29)24-17-11-23-16(8-5-9-18(23)26)20(24)19(15(17)12-25)21(27)22(2)3/h4-10,15,17,19-20,25H,11-12H2,1-3H3/t15-,17-,19+,20+/m1/s1
InChIKey DIVLOMPALFPCBT-BEKAIBRUSA-N
SMILES CC1=CC(=CC=C1)S(=O)(=O)N2[C@@H]3CN4C(=O)C=CC=C4[C@H]2[C@H]([C@@H]3CO)C(=O)N(C)C
ChEBI Ontology
Outgoing LSM-14076 (CHEBI:102730) is a sulfonamide (CHEBI:35358)
Manual Xref Database
LSM-14076 LINCS
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