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CHEBI:758110 - bms-986251

Default Structure
ChEBI IDCHEBI:758110
ChEBI Namebms-986251
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC30H29F8NO5S
Net Charge0
Average Mass667.615
Monoisotopic Mass667.16387
SMILES[H][C@@]12CCc3cc(C(F)(C(F)(F)F)C(F)(F)F)ccc3[C@]1(S(=O)(=O)c1ccc(F)cc1)CCN2C(=O)[C@@H]1CC[C@@H](C(=O)O)C[C@@H]1C
InChIInChI=1S/C30H29F8NO5S/c1-16-14-18(26(41)42)2-9-22(16)25(40)39-13-12-27(45(43,44)21-7-5-20(31)6-8-21)23-10-4-19(15-17(23)3-11-24(27)39)28(32,29(33,34)35)30(36,37)38/h4-8,10,15-16,18,22,24H,2-3,9,11-14H2,1H3,(H,41,42)/t16-,18+,22+,24+,27+/m0/s1
InChIKeyJQORWGARJVSRBA-QOTTZFGFSA-N
ChEBI Ontology
Outgoing Relation(s)
bms-986251 (CHEBI:758110) is a tetralins (CHEBI:36786)
Synonym  Source
BMS-986251ChEMBL
Citations