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Details

Stereochemistry ABSOLUTE
Molecular Formula C33H30F2N2O5
Molecular Weight 572.5985
Optical Activity ( + )
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4S)-3-[(2R,5R)-5-(4-Fluorophenyl)-2-[(S)-[(4-fluorophenyl)amino](4-hydroxyphenyl)methyl]-5-hydroxy-1-oxopentyl]-4-phenyl-2-oxazolidinone

SMILES

O[C@H](CC[C@H]([C@H](NC1=CC=C(F)C=C1)C2=CC=C(O)C=C2)C(=O)N3[C@H](COC3=O)C4=CC=CC=C4)C5=CC=C(F)C=C5

InChI

InChIKey=WYMDQBFNYMAMNK-OMRVPHBLSA-N
InChI=1S/C33H30F2N2O5/c34-24-10-6-22(7-11-24)30(39)19-18-28(32(40)37-29(20-42-33(37)41)21-4-2-1-3-5-21)31(23-8-16-27(38)17-9-23)36-26-14-12-25(35)13-15-26/h1-17,28-31,36,38-39H,18-20H2/t28-,29-,30-,31-/m1/s1

HIDE SMILES / InChI

Molecular Formula C33H30F2N2O5
Molecular Weight 572.5985
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:54:01 GMT 2023
Edited
by admin
on Sat Dec 16 19:54:01 GMT 2023
Record UNII
2E8C9LD7Q4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(4S)-3-[(2R,5R)-5-(4-Fluorophenyl)-2-[(S)-[(4-fluorophenyl)amino](4-hydroxyphenyl)methyl]-5-hydroxy-1-oxopentyl]-4-phenyl-2-oxazolidinone
Systematic Name English
2-Oxazolidinone, 3-[(2R,5R)-5-(4-fluorophenyl)-2-[(S)-[(4-fluorophenyl)amino](4-hydroxyphenyl)methyl]-5-hydroxy-1-oxopentyl]-4-phenyl-, (4S)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID901101587
Created by admin on Sat Dec 16 19:54:01 GMT 2023 , Edited by admin on Sat Dec 16 19:54:01 GMT 2023
PRIMARY
PUBCHEM
125317966
Created by admin on Sat Dec 16 19:54:01 GMT 2023 , Edited by admin on Sat Dec 16 19:54:01 GMT 2023
PRIMARY
FDA UNII
2E8C9LD7Q4
Created by admin on Sat Dec 16 19:54:01 GMT 2023 , Edited by admin on Sat Dec 16 19:54:01 GMT 2023
PRIMARY
CAS
1296129-16-2
Created by admin on Sat Dec 16 19:54:01 GMT 2023 , Edited by admin on Sat Dec 16 19:54:01 GMT 2023
PRIMARY