Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0ML3S
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| Former ID |
DNC012457
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| Drug Name |
2,4-bis-docosanoylamino-benzenesulfonate
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| Synonyms |
CHEMBL96329
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C50H91N2NaO5S
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| Canonical SMILES |
CCCCCCCCCCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)S(=O)(=O)[O-])NC(=O)CCCCCCCCCCCCCCCCCCCCC.[Na+]
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| InChI |
1S/C50H92N2O5S.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-49(53)51-46-43-44-48(58(55,56)57)47(45-46)52-50(54)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h43-45H,3-42H2,1-2H3,(H,51,53)(H,52,54)(H,55,56,57);/q;+1/p-1
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| InChIKey |
IXCBRSKAYDVLLF-UHFFFAOYSA-M
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Scavenger receptor A1 (MSR1) | Target Info | Inhibitor | [1] |
| KEGG Pathway | Phagosome | |||
| NetPath Pathway | TCR Signaling Pathway | |||
| Reactome | Scavenging by Class A Receptors | |||
| WikiPathways | Binding and Uptake of Ligands by Scavenger Receptors | |||
| AGE/RAGE pathway | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | 2,4-Bis(octadecanoylamino)benzenesulfonic acid sodium salt as a novel scavenger receptor inhibitor with low molecular weight. Bioorg Med Chem Lett. 2004 Jun 7;14(11):2791-5. | |||
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