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ChEMBL

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ChEMBL Statistics
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UniChem Connectivity Layer Cross References

Legend

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

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



Source Identical Component s i p si ip sp sip
ChEMBL CHEMBL457299
PDBe EDO
KEGG Ligand C01380 C15588
ChEBI 30742
ZINC ZINC000005224354
eMolecules 475071 26753842 517848
IBM Patent System 9D56FB69EEFAC120ABF9E19B2E7F634B 542AC019A092E15FF6E7A3785C4B4880 B07ECAF3BD496D56E59A662C69C07709 3718D4FF0758D8BD66617DCF7779459F F6AA9E2C30B823639735F4C868948AA0 8C854850F1FD70C829E4460FEDE73C66
FDA SRS FC72KVT52F
SureChEMBL SCHEMBL3 SCHEMBL1332716 SCHEMBL2307225 SCHEMBL1495066 SCHEMBL1331966 SCHEMBL18877065 SCHEMBL175268
Human Metabolome Database HMDB0037790
PubChem: Thomson Pharma 15119591 16930464 16043886
PubChem 174 59069648 16213434 11815275 90475996 76972938 2733137 134462 129660324 91203794 2733139 21334931 10986148 12196520 3346050 20395750 23553108
Mcule MCULE-6366313128
NMRShiftDB 10005600
ACToR 37225-26-6 25322-68-3 107-21-1 59609-67-5 15054-86-1
MolPort MolPort-000-872-014 MolPort-003-935-980
Nikkaji J4.061D J299.175F J762.893E J819.938H J247.669J J3.124.717I
EPA CompTox Dashboard DTXSID8020597 DTXSID40583948 DTXSID40208285 DTXSID20450700 DTXSID00164570
Metabolights MTBLC30742
Brenda 174847 93653 121788 3957 123754 164335 44184 1410 29991 21240 9160
Rhea 30742

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