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CHEBI:760309 - vanzacaftor calcium

Default Structure
ChEBI IDCHEBI:760309
ChEBI Namevanzacaftor calcium
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaCa.C32H38N7O4S.C32H38N7O4S
Net Charge0
Average Mass1273.614
Monoisotopic Mass1272.50379
SMILES[Ca+2].[H][C@@]12CCCNc3cccc(n3)S(=O)(=O)[N-]C(=O)c3ccc(-n4ccc(OCCC5C6(CC6)C56CC6)n4)nc3N(C1)C(C)(C)C2.[H][C@@]12CCCNc3cccc(n3)S(=O)(=O)[N-]C(=O)c3ccc(-n4ccc(OCCC5C6(CC6)C56CC6)n4)nc3N(C1)C(C)(C)C2
InChIInChI=1S/2C32H39N7O4S.Ca/c2*1-30(2)19-21-5-4-16-33-24-6-3-7-27(34-24)44(41,42)37-29(40)22-8-9-25(35-28(22)38(30)20-21)39-17-10-26(36-39)43-18-11-23-31(12-13-31)32(23)14-15-32;/h2*3,6-10,17,21,23H,4-5,11-16,18-20H2,1-2H3,(H2,33,34,37,40);/q;;+2/p-2/t2*21-;/m00./s1
InChIKeyANPVHAQPVLJLSP-HRQBZJEISA-L
ChEBI Ontology
Outgoing Relation(s)
vanzacaftor calcium (CHEBI:760309) is a pyrazolopyridine (CHEBI:46699)
Synonyms  Source
Vanzacaftor calciumChEMBL
Vanzacaftor hemicalciumChEMBL
VX-121 Calcium SaltChEMBL