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Details

Stereochemistry ABSOLUTE
Molecular Formula C33H39N7O7S
Molecular Weight 677.77
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[5-[4?-[[2-Butyl-5-[2-(dimethylamino)-2-thioxoethyl]-4-methyl-6-oxo-1(6H)-pyrimidinyl]methyl][1,1?-biphenyl]-2-yl]-1H-tetrazol-1-yl]-1-deoxy-?-D-glucopyranuronic acid

SMILES

CCCCC1=NC(C)=C(CC(=S)N(C)C)C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN=NN4[C@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O

InChI

InChIKey=FPUOUXBBCDSIBJ-AHCJWZABSA-N
InChI=1S/C33H39N7O7S/c1-5-6-11-24-34-18(2)23(16-25(48)38(3)4)31(44)39(24)17-19-12-14-20(15-13-19)21-9-7-8-10-22(21)30-35-36-37-40(30)32-28(43)26(41)27(42)29(47-32)33(45)46/h7-10,12-15,26-29,32,41-43H,5-6,11,16-17H2,1-4H3,(H,45,46)/t26-,27-,28+,29-,32-/m0/s1

HIDE SMILES / InChI

Molecular Formula C33H39N7O7S
Molecular Weight 677.77
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 Wed Apr 02 21:17:56 GMT 2025
Edited
by admin
on Wed Apr 02 21:17:56 GMT 2025
Record UNII
Z35KEZ2BDU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Fimasartan metabolite M10
Preferred Name English
1-[5-[4?-[[2-Butyl-5-[2-(dimethylamino)-2-thioxoethyl]-4-methyl-6-oxo-1(6H)-pyrimidinyl]methyl][1,1?-biphenyl]-2-yl]-1H-tetrazol-1-yl]-1-deoxy-?-D-glucopyranuronic acid
Systematic Name English
?-D-Glucopyranuronic acid, 1-[5-[4?-[[2-butyl-5-[2-(dimethylamino)-2-thioxoethyl]-4-methyl-6-oxo-1(6H)-pyrimidinyl]methyl][1,1?-biphenyl]-2-yl]-1H-tetrazol-1-yl]-1-deoxy-
Systematic Name English
Code System Code Type Description
FDA UNII
Z35KEZ2BDU
Created by admin on Wed Apr 02 21:17:56 GMT 2025 , Edited by admin on Wed Apr 02 21:17:56 GMT 2025
PRIMARY
CAS
2068809-94-7
Created by admin on Wed Apr 02 21:17:56 GMT 2025 , Edited by admin on Wed Apr 02 21:17:56 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE INACTIVE
MAJOR
FECAL