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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H25F3N2O6
Molecular Weight 482.4496
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4S,5S)-4-HYDROXY-5-METHYL-5-((4-(4-(4-(TRIFLUOROMETHOXY)PHENOXY)-1-PIPERIDINYL)PHENOXY)METHYL)-2-OXAZOLIDINONE

SMILES

[H][C@@]1(O)NC(=O)O[C@@]1(C)COC2=CC=C(C=C2)N3CCC(CC3)OC4=CC=C(OC(F)(F)F)C=C4

InChI

InChIKey=KLVSNMXKCKZXKU-UNMCSNQZSA-N
InChI=1S/C23H25F3N2O6/c1-22(20(29)27-21(30)34-22)14-31-16-4-2-15(3-5-16)28-12-10-18(11-13-28)32-17-6-8-19(9-7-17)33-23(24,25)26/h2-9,18,20,29H,10-14H2,1H3,(H,27,30)/t20-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H25F3N2O6
Molecular Weight 482.4496
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:12:29 GMT 2023
Edited
by admin
on Sat Dec 16 15:12:29 GMT 2023
Record UNII
QEJ6V40GFN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(4S,5S)-4-HYDROXY-5-METHYL-5-((4-(4-(4-(TRIFLUOROMETHOXY)PHENOXY)-1-PIPERIDINYL)PHENOXY)METHYL)-2-OXAZOLIDINONE
Systematic Name English
2-OXAZOLIDINONE, 4-HYDROXY-5-METHYL-5-((4-(4-(4-(TRIFLUOROMETHOXY)PHENOXY)-1-PIPERIDINYL)PHENOXY)METHYL)-, (4S,5S)-
Systematic Name English
DELAMANID METABOLITE M7
Common Name English
Code System Code Type Description
PUBCHEM
140148507
Created by admin on Sat Dec 16 15:12:30 GMT 2023 , Edited by admin on Sat Dec 16 15:12:30 GMT 2023
PRIMARY
FDA UNII
QEJ6V40GFN
Created by admin on Sat Dec 16 15:12:30 GMT 2023 , Edited by admin on Sat Dec 16 15:12:30 GMT 2023
PRIMARY
CAS
1202876-13-8
Created by admin on Sat Dec 16 15:12:30 GMT 2023 , Edited by admin on Sat Dec 16 15:12:30 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
PLASMA