General Information of DIG (ID: E0BQ1W)
DIG Name
Ammonium alginate
Synonyms    Click to Show/Hide the Synonyms of This DIG
6-(2-carboxy-4,5-dihydroxy-6-methoxyoxan-3-yl)oxy-4,5-dihydroxy-3-methoxyoxane-2-carboxylic acid; 9005-34-9; 3-((6-carboxy-3,4-dihydroxy-5-methoxytetrahydro-2H-pyran-2-yl)oxy)-4,5-dihydroxy-6-methoxytetrahydro-2H-pyran-2-carboxylic acid; Alginic acid, ammoniumsalt; SCHEMBL10118904; AKOS015915207; A843434; 6-[(2-carboxy-4,5-dihydroxy-6-methoxy-3-oxanyl)oxy]-4,5-dihydroxy-3-methoxy-2-oxanecarboxylic acid; 6-[2-carboxy-6-methoxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-3-methoxy-4,5-bis(oxidanyl)oxane-2-carboxylic acid
DIG Function
Binding agent; Emulsifying agent; Film/membrane-forming agent; Gelling agent; Humectant; Viscosity-controlling agent
PubChem CID
6850754
Formula
C14H22O13
Canonical SMILES
COC1C(C(C(OC1C(=O)O)OC2C(C(C(OC2C(=O)O)OC)O)O)O)O
InChI
1S/C14H22O13/c1-23-7-3(15)6(18)14(27-9(7)11(19)20)25-8-4(16)5(17)13(24-2)26-10(8)12(21)22/h3-10,13-18H,1-2H3,(H,19,20)(H,21,22)
InChIKey
GKFPPCXIBHQRQT-UHFFFAOYSA-N
   Click to Show/Hide the Molecular Data (Structure/Property) of This DIG
Structure
<iframe style="width: 300px; height: 300px;" frameborder="0" src="https://embed.molview.org/v1/?mode=balls&cid=6850754"></iframe>
3D MOL is not available 2D MOL
Physicochemical Properties Molecular Weight 398.32 Topological Polar Surface Area 202
XlogP -3.7 Complexity 541
Heavy Atom Count 27 Rotatable Bond Count 6
Hydrogen Bond Donor Count 6 Hydrogen Bond Acceptor Count 13
Full List of Active Pharmaceutical Ingredients (APIs) Co-administrated with This DIG
       ICD Disease Classification 15 Musculoskeletal/connective-tissue disease Click to Show/Hide
Metaxalone
API Info
Myalgia [ICD-11: FB56]
[1]
References
1 FDA label for approved metaxalone from the official website of the U.S. Food and Drug Administration.

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