Drug Information

Drug General Information
Drug ID
D08WQM
Former ID
DNC002796
Drug Name
O-Sialic Acid
Drug Type
Small molecular drug
Indication Discovery agent Investigative [551374]
Formula
C11H19NO9
Canonical SMILES
CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)O)O
InChI
1S/C11H19NO9/c1-4(14)12-7-5(15)2-11(20,10(18)19)21-9(7)8(17)6(16)3-13/h5-9,13,15-17,20H,2-3H2,1H3,(H,12,14)(H,18,19)/t5-,6+,7+,8+,9+,11?/m0/s1
InChIKey
SQVRNKJHWKZAKO-LUWBGTNYSA-N
PubChem Compound ID
439197
PubChem Substance ID
3568, 8145622, 10298244, 16923840, 36883451, 57402903, 78603068, 85164905, 104619874, 144226571, 162023995, 163136445, 172914264, 175443104, 202557359, 224593194, 226587554, 252089093, 252124524, 252283204, 252818031
Target and Pathway
Target(s) P-selectin Target Info Inhibitor [551374]
Neuraminidase Target Info Inhibitor [551374]
E-selectin Target Info Inhibitor [551374]
Liver carboxylesterase Target Info Inhibitor [551374]
KEGG Pathway Cell adhesion molecules (CAMs)
Malaria
Staphylococcus aureus infectionstm00511:Other glycan degradationhsa04514:Cell adhesion molecules (CAMs)
TNF signaling pathway
African trypanosomiasis
Malariahsa00983:Drug metabolism - other enzymes
Metabolic pathways
NetPath Pathway IL5 Signaling Pathway
IL4 Signaling Pathway
TNFalpha Signaling Pathway
ID Signaling Pathway
Pathway Interaction Database IL4-mediated signaling events
amb2 Integrin signalingtxa2pathway:Thromboxane A2 receptor signaling
Glucocorticoid receptor regulatory network
ATF-2 transcription factor networke2f_pathway:E2F transcription factor network
Reactome Platelet degranulation
Cell surface interactions at the vascular wallR-HSA-202733:Cell surface interactions at the vascular wall
WikiPathways Human Complement System
Spinal Cord Injury
Cell surface interactions at the vascular wallWP2806:Human Complement System
TNF alpha Signaling Pathway
Cell surface interactions at the vascular wallWP2884:NRF2 pathway
Nuclear Receptors Meta-Pathway
Heroin metabolism
Irinotecan Pathway
Fluoropyrimidine Activity
Phase I biotransformations, non P450
References
Ref 551374The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42.
Ref 551374The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42.

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