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UniChem Connectivity Layer Cross References

Legend

Letters 's', 'i' and 'p' describe how structures differ from structure with InChI Key JXOHGGNKMLTUBP-HSUXUTPPSA-N

  • s = stereochemical difference.
  • i = isotopic difference.
  • p = protonation differences identified.



Source Identical Component s i p si ip sp sip
ChEMBL CHEMBL290345 CHEMBL3348832
PDBe SKM
KEGG Ligand C00493
ChEBI 16119 132329 36208
ZINC ZINC000003860720 ZINC000009214237 ZINC000005273809 ZINC000003870235 ZINC000008681449 ZINC000004025808 ZINC000003870233 ZINC000003870234
eMolecules 531403 36516832 36760095 29549772
IBM Patent System 1CBAF232FF02CC01653361513A365D5C 5622697B4DED0CA7CD92BE16945EF91F 3729B7406A9A96D62FB123F3CB6D024A 1862017F94C0A8C02452AD1DBB1C404D 29DDC338071AAB6A3605A822DB0C8F38 505D4D47C6EAF0BBE04061448F7C979F A8E94BE741AF72B663E2AD8BFFCA4D1B 991DDBD63958DC392AED5335BA5DB07F FE7FCDBFB9021224F1D75AF198B190EF 7B3F93314D97B043977C3645961C0F36
FDA SRS 29MS2WI2NU
SureChEMBL SCHEMBL7821291 SCHEMBL16915299 SCHEMBL5325325 SCHEMBL43377 SCHEMBL12833224 SCHEMBL9885028 SCHEMBL5874199 SCHEMBL5874185 SCHEMBL5874962 SCHEMBL5874728 SCHEMBL5874809 SCHEMBL5874450 SCHEMBL5874291 SCHEMBL13577074 SCHEMBL5874967 SCHEMBL5874872 SCHEMBL8943144 SCHEMBL5875404 SCHEMBL5874876 SCHEMBL19260563 SCHEMBL9619090 SCHEMBL5874254 SCHEMBL4394639 SCHEMBL5874598 SCHEMBL43376 SCHEMBL5875333 SCHEMBL5875338 SCHEMBL10042220 SCHEMBL5874234 SCHEMBL5874873 SCHEMBL5874970 SCHEMBL5875125 SCHEMBL2781123 SCHEMBL15144346 SCHEMBL5874159 SCHEMBL5874799 SCHEMBL12761890 SCHEMBL12761899 SCHEMBL12761891 SCHEMBL12761896
Human Metabolome Database HMDB0003070 HMDB0130150
Selleck Shikimic-acid(Shikimate)
PubChem: Thomson Pharma 26516664 140109267 14748221 16044871 16423009 16902449 14968145 15091495 15995852
PubChem 59054327 16656776 118239204 69406016 8742 131737518 49873874 438096 21902756 59081897 21902995 21903440 15117162 130345694 24202010 21903077 11332752 21903179 10986763 21902827 49867941 21903367 21903411 21903549 40970370 21902907 21903375 24202011 11789701 5107317 50919565 1094 21903408 125909 21903059 21903141 42626655 12315501 21902724 21903158 69027491 67532254 21902912 21902919 21902966 21902703 21626190 16758061 7076075 21903170 12315498 25239957 101162055 9989730 59869332 101751431 59869334 101750548 59869331 7057976 10103663 40467899 7076074 21872888 40467900 40467898
Mcule MCULE-9138847690 MCULE-8467892216 MCULE-1078524667 MCULE-9666987410 MCULE-5188930606 MCULE-9741453604 MCULE-1768967414 MCULE-2599314177 MCULE-5324189893 MCULE-5029345256
NMRShiftDB 20096803
ACToR 138-59-0 96322-25-7
MolPort MolPort-002-507-279 MolPort-016-633-340 MolPort-006-328-697
Nikkaji J3.267K J156.705E J870.914I J793.784I J2.218.118A J691.062I J23.532F J875.538H J2.979.440E J1.697.437D J1.945.206I J1.943.278E
BindingDB 50281998
EPA CompTox Dashboard DTXSID4032039
Metabolights MTBLC16119 MTBLC132329 MTBLC36208
Brenda 42735 352 199524 9270 213314 213315
Rhea 36208
ChemicalBook CB2293550

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/key_search/JXOHGGNKMLTUBP-HSUXUTPPSA-N/0/0/4
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