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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H20F2N5O5PS.C6H14N2O2
Molecular Weight 693.659
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FOSRAVUCONAZOLE L-LYSINE

SMILES

NCCCC[C@H](N)C(O)=O.C[C@@H](C1=NC(=CS1)C2=CC=C(C=C2)C#N)[C@@](CN3C=NC=N3)(OCOP(O)(O)=O)C4=CC=C(F)C=C4F

InChI

InChIKey=GTJFQIOLLGYOSL-SWQYEYERSA-N
InChI=1S/C23H20F2N5O5PS.C6H14N2O2/c1-15(22-29-21(10-37-22)17-4-2-16(9-26)3-5-17)23(11-30-13-27-12-28-30,34-14-35-36(31,32)33)19-7-6-18(24)8-20(19)25;7-4-2-1-3-5(8)6(9)10/h2-8,10,12-13,15H,11,14H2,1H3,(H2,31,32,33);5H,1-4,7-8H2,(H,9,10)/t15-,23+;5-/m00/s1

HIDE SMILES / InChI

Molecular Formula C23H20F2N5O5PS
Molecular Weight 547.471
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C6H14N2O2
Molecular Weight 146.1876
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:01:42 UTC 2023
Edited
by admin
on Sat Dec 16 08:01:42 UTC 2023
Record UNII
0R566UQ5QN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FOSRAVUCONAZOLE L-LYSINE
Common Name English
L-LYSINE, COMPD. WITH 4-(2-((1R,2R)-2-(2,4-DIFLUOROPHENYL)-1-METHYL-2-((PHOSPHONOOXY)METHOXY)-3-(1H-1,2,4-TRIAZOL-1-YL)PROPYL)-4-THIAZOLYL)BENZONITRILE (1:1)
Systematic Name English
RAVUCONAZOLE METHYLPHOSPHATE, MONOLYSINE SALT
Common Name English
RAVUCONAZOLE METHYLPHOSPHATE MONOLYSINE
Common Name English
Code System Code Type Description
PUBCHEM
119025899
Created by admin on Sat Dec 16 08:01:42 UTC 2023 , Edited by admin on Sat Dec 16 08:01:42 UTC 2023
PRIMARY
FDA UNII
0R566UQ5QN
Created by admin on Sat Dec 16 08:01:42 UTC 2023 , Edited by admin on Sat Dec 16 08:01:42 UTC 2023
PRIMARY
CAS
914361-44-7
Created by admin on Sat Dec 16 08:01:42 UTC 2023 , Edited by admin on Sat Dec 16 08:01:42 UTC 2023
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS
PARENT -> SALT/SOLVATE
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ACTIVE MOIETY