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CHEBI:758783 - yimitasvir phosphate

Default Structure
ChEBI IDCHEBI:758783
ChEBI Nameyimitasvir phosphate
Stars
Last Modified30 June 2026
Submitterchembl-etl
DownloadsMolfile
FormulaH3O4P.C49H58N8O6.H3O4P
Net Charge0
Average Mass1051.041
Monoisotopic Mass1050.40172
SMILESCOC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4ccc5nc([C@@H]6CCCN6C(=O)[C@@H](NC(=O)OC)C(C)C)nc5c4)c4c3[C@@H]3CC[C@H]4C3)cc2)n1)C(C)C.O=P(O)(O)O.O=P(O)(O)O
InChIInChI=1S/C49H58N8O6.2H3O4P/c1-26(2)42(54-48(60)62-5)46(58)56-21-7-9-38(56)44-50-25-37(53-44)29-13-11-28(12-14-29)33-18-19-34(41-32-16-15-31(23-32)40(33)41)30-17-20-35-36(24-30)52-45(51-35)39-10-8-22-57(39)47(59)43(27(3)4)55-49(61)63-6;2*1-5(2,3)4/h11-14,17-20,24-27,31-32,38-39,42-43H,7-10,15-16,21-23H2,1-6H3,(H,50,53)(H,51,52)(H,54,60)(H,55,61);2*(H3,1,2,3,4)/t31-,32+,38+,39+,42+,43+;;/m1../s1
InChIKeyKRUXCUGAHYWSKK-RTNSEEPCSA-N
Roles Classification
Application:
renoprotective agent  Any compound that is able to prevent damage to the kidneys.
ChEBI Ontology
Outgoing Relation(s)
yimitasvir phosphate (CHEBI:758783) has role renoprotective agent (CHEBI:231911)
yimitasvir phosphate (CHEBI:758783) is a valine derivative (CHEBI:27267)
Synonyms  Source
DAG-181 DIPHOSPHATEChEMBL
DAG181 DIPHOSPHATEChEMBL
Yimitasvir phosphateChEMBL