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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H28N2O10S
Molecular Weight 596.605
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SULFINPYRAZONE-C-GLUCURONIDE

SMILES

[H][C@]1(O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)C3(CCS(=O)(=O)C2=CC=CC=C2)C(=O)N(N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChIKey=RYSOXAAEAINHER-ARXROMJUSA-N
InChI=1S/C29H28N2O10S/c32-21-22(33)24(26(35)36)41-25(23(21)34)29(16-17-42(39,40)20-14-8-3-9-15-20)27(37)30(18-10-4-1-5-11-18)31(28(29)38)19-12-6-2-7-13-19/h1-15,21-25,32-34H,16-17H2,(H,35,36)/t21-,22-,23+,24-,25+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
SULFINPYRAZONE-C-GLUCURONIDE
Common Name English
.BETA.-D-GLUCOPYRANURONIC ACID, 1-DEOXY-1-(3,5-DIOXO-1,2-DIPHENYL-4-(2-(PHENYLSULFONYL)ETHYL)-4-PYRAZOLIDINYL)-
Systematic Name English
Code System Code Type Description
CAS
58648-69-4
Created by admin on Sat Dec 16 13:31:13 GMT 2023 , Edited by admin on Sat Dec 16 13:31:13 GMT 2023
PRIMARY
FDA UNII
Q9BR5Q8U97
Created by admin on Sat Dec 16 13:31:13 GMT 2023 , Edited by admin on Sat Dec 16 13:31:13 GMT 2023
PRIMARY
PUBCHEM
156028080
Created by admin on Sat Dec 16 13:31:13 GMT 2023 , Edited by admin on Sat Dec 16 13:31:13 GMT 2023
PRIMARY