Responsive image

Common name


Spaglumic Acid

IUPAC name


(2R)-2-[(3S)-3-carboxy-3-acetamidopropanamido]pentanedioic acid

SMILES


CC(=O)N[C@@H](CC(=O)N[C@H](CCC(O)=O)C(O)=O)C(O)=O

Compound class


Mast Cell Stabilizers; Respiratory System; Ophthalmologicals; Sensory Organs; Nasal Preparations; Decongestants and Antiallergics; Antiallergic Agents, Excl. Corticosteroids;

Therapeutic area


Used in patients with allergic conjunctivitis.

Common name


Spaglumic Acid

IUPAC name


(2R)-2-[(3S)-3-carboxy-3-acetamidopropanamido]pentanedioic acid

SMILES


CC(=O)N[C@@H](CC(=O)N[C@H](CCC(O)=O)C(O)=O)C(O)=O

INCHI


InChI=1S/C11H16N2O8/c1-5(14)12-7(11(20)21)4-8(15)13-6(10(18)19)2-3-9(16)17/h6-7H,2-4H2,1H3,(H,12,14)(H,13,15)(H,16,17)(H,18,19)(H,20,21)/t6-,7+/m1/s1

FORMULA


C11H16N2O8

Responsive image

Common name


Spaglumic Acid

IUPAC name


(2R)-2-[(3S)-3-carboxy-3-acetamidopropanamido]pentanedioic acid

Molecular weight


304.253

clogP


-1.346

clogS


0.311

HBond Acceptor


8

HBond Donor


5

Total Polar
Surface Area


170.1

Number of Rings


0

Rotatable Bond


9

Drug ID Common name Structure CAS SMILE Frequency
FDBF00003 formamide Responsive image C(=O)N 0.1240
FDBF00004 acetic acid Responsive image CC(=O)O 0.0687
FDBF00015 acetamide Responsive image NC(=O)C 0.0460
FDBF00047 propionic acid Responsive image CCC(=O)O 0.0395
4 , 1