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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H23F10NO4
Molecular Weight 639.4813
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4S,5R)-5-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-((4'-FLUORO-2',3'-DIHYDROXY-5'-(1-METHYLETHYL)-4-(TRIFLUOROMETHYL)(1,1'-BIPHENYL)-2-YL)METHYL)-4-METHYL-2-OXAZOLIDINONE

SMILES

CC(C)C1=C(F)C(O)=C(O)C(=C1)C2=C(CN3[C@@H](C)[C@H](OC3=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)C=C(C=C2)C(F)(F)F

InChI

InChIKey=DFFYRGDTASCAMI-CANCMXDXSA-N
InChI=1S/C29H23F10NO4/c1-12(2)20-10-21(23(41)24(42)22(20)30)19-5-4-16(27(31,32)33)8-15(19)11-40-13(3)25(44-26(40)43)14-6-17(28(34,35)36)9-18(7-14)29(37,38)39/h4-10,12-13,25,41-42H,11H2,1-3H3/t13-,25-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
(4S,5R)-5-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-((4'-FLUORO-2',3'-DIHYDROXY-5'-(1-METHYLETHYL)-4-(TRIFLUOROMETHYL)(1,1'-BIPHENYL)-2-YL)METHYL)-4-METHYL-2-OXAZOLIDINONE
Systematic Name English
(4S,5R)-5-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-((4'-FLUORO-2',3'-DIHYDROXY-5'-ISOPROPYL-4-(TRIFLUOROMETHYL)BIPHENYL-2-YL)METHYL)-4-METHYL-1,3-OXAZOLIDIN-2-ONE
Systematic Name English
ANACETRAPIB METABOLITE M2
Common Name English
2-OXAZOLIDINONE, 5-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-((4'-FLUORO-2',3'-DIHYDROXY-5'-(1-METHYLETHYL)-4-(TRIFLUOROMETHYL)(1,1'-BIPHENYL)-2-YL)METHYL)-4-METHYL-, (4S,5R)-
Systematic Name English
Code System Code Type Description
FDA UNII
204N3XHI80
Created by admin on Sat Dec 16 16:10:42 GMT 2023 , Edited by admin on Sat Dec 16 16:10:42 GMT 2023
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PUBCHEM
11549128
Created by admin on Sat Dec 16 16:10:42 GMT 2023 , Edited by admin on Sat Dec 16 16:10:42 GMT 2023
PRIMARY
CAS
875550-15-5
Created by admin on Sat Dec 16 16:10:42 GMT 2023 , Edited by admin on Sat Dec 16 16:10:42 GMT 2023
PRIMARY