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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H26N4O8
Molecular Weight 486.4745
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PF-04580552

SMILES

CCC1=NN(CCO[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)C(CC)=C1OC3=CC(=CC(=C3)C#N)C#N

InChI

InChIKey=MHVKUKFIYQCCFF-VLXBDIDVSA-N
InChI=1S/C23H26N4O8/c1-3-15-20(34-14-8-12(10-24)7-13(9-14)11-25)16(4-2)27(26-15)5-6-33-23-19(30)17(28)18(29)21(35-23)22(31)32/h7-9,17-19,21,23,28-30H,3-6H2,1-2H3,(H,31,32)/t17-,18-,19+,21-,23+/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H26N4O8
Molecular Weight 486.4745
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:46:44 UTC 2023
Edited
by admin
on Sat Dec 16 15:46:44 UTC 2023
Record UNII
2FB3ZTE7U2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PF-04580552
Code English
LERSIVIRINE METABOLITE M15
Common Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 2-(4-(3,5-DICYANOPHENOXY)-3,5-DIETHYL-1H-PYRAZOL-1-YL)ETHYL
Systematic Name English
2-(4-(3,5-DICYANOPHENOXY)-3,5-DIETHYL-1H-PYRAZOL-1-YL)ETHYL .BETA.-D-GLUCOPYRANOSIDURONIC ACID
Common Name English
Code System Code Type Description
PUBCHEM
156028056
Created by admin on Sat Dec 16 15:46:44 UTC 2023 , Edited by admin on Sat Dec 16 15:46:44 UTC 2023
PRIMARY
FDA UNII
2FB3ZTE7U2
Created by admin on Sat Dec 16 15:46:44 UTC 2023 , Edited by admin on Sat Dec 16 15:46:44 UTC 2023
PRIMARY
CAS
1633831-66-9
Created by admin on Sat Dec 16 15:46:44 UTC 2023 , Edited by admin on Sat Dec 16 15:46:44 UTC 2023
PRIMARY
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