maralixibat (CHEBI:748720)

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CHEBI:748720 - maralixibat

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ChEBI ID	CHEBI:748720
ChEBI Name	maralixibat
Stars
Last Modified	29 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C40H56N3O4S
Net Charge	+1
Average Mass	674.972
Monoisotopic Mass	674.39860
SMILES	[H][C@@]1(O)[C@H](c2ccc(OCc3ccc(C[N+]45CCN(CC4)CC5)cc3)cc2)c2cc(N(C)C)ccc2S(=O)(=O)CC1(CCCC)CCCC
InChI	InChI=1S/C40H56N3O4S/c1-5-7-19-40(20-8-6-2)30-48(45,46)37-18-15-34(41(3)4)27-36(37)38(39(40)44)33-13-16-35(17-14-33)47-29-32-11-9-31(10-12-32)28-43-24-21-42(22-25-43)23-26-43/h9-18,27,38-39,44H,5-8,19-26,28-30H2,1-4H3/q+1/t38-,39-/m1/s1
InChIKey	STPKWKPURVSAJF-LJEWAXOPSA-N

ChEBI Ontology

Outgoing Relation(s)
	maralixibat (CHEBI:748720) is a organic heterobicyclic compound (CHEBI:27171)
	maralixibat (CHEBI:748720) is a organosulfur heterocyclic compound (CHEBI:38106)

Synonyms	Source
Lopixibat	ChEMBL
LUM-001 CATION	ChEMBL
LUM001 CATION	ChEMBL
Maralixibat	ChEMBL
Maralixibat cation	ChEMBL
TAK-625	ChEMBL

Citations