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Details

Stereochemistry EPIMERIC
Molecular Formula C26H25N2O8S.Na
Molecular Weight 548.54
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 4
E/Z Centers 0
Charge 0
Stereo Comments Assumed epimeric

SHOW SMILES / InChI
Structure of 6-(2-PHENYL-2-(4-CARBOMETHOXYMETHYLPHENOXYCARBONYL)ACETAMIDO)PENICILLANIC ACID SODIUM

SMILES

[Na+].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C(C(=O)OC3=CC=C(CC(=O)OC)C=C3)C4=CC=CC=C4)C([O-])=O

InChI

InChIKey=QYFSWQBKRXTRNX-XZVIDJSISA-M
InChI=1S/C26H26N2O8S.Na/c1-26(2)20(24(32)33)28-22(31)19(23(28)37-26)27-21(30)18(15-7-5-4-6-8-15)25(34)36-16-11-9-14(10-12-16)13-17(29)35-3;/h4-12,18-20,23H,13H2,1-3H3,(H,27,30)(H,32,33);/q;+1/p-1/t18?,19-,20+,23-;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
6-(2-PHENYL-2-(4-CARBOMETHOXYMETHYLPHENOXYCARBONYL)ACETAMIDO)PENICILLANIC ACID SODIUM
Common Name English
MALONAMIC ACID, N-(2-CARBOXY-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPT-6-YL)-2-PHENYL-, 1-ESTER WITH METHYL (P-HYDROXYPHENYL)ACETATE, MONOSODIUM SALT
Systematic Name English
Code System Code Type Description
PUBCHEM
137321742
Created by admin on Sat Dec 16 05:26:16 GMT 2023 , Edited by admin on Sat Dec 16 05:26:16 GMT 2023
PRIMARY
CAS
31750-52-4
Created by admin on Sat Dec 16 05:26:16 GMT 2023 , Edited by admin on Sat Dec 16 05:26:16 GMT 2023
PRIMARY
FDA UNII
47QUH6I5MR
Created by admin on Sat Dec 16 05:26:16 GMT 2023 , Edited by admin on Sat Dec 16 05:26:16 GMT 2023
PRIMARY