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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 BWWVAEOLVKTZFQ-ISVUSNJMSA-N

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



Source Identical Component s i p si ip sp sip
ChEMBL CHEMBL1204895 CHEMBL285438 CHEMBL286095 CHEMBL530 CHEMBL1206590 CHEMBL33900 CHEMBL35138 CHEMBL1204938 CHEMBL35325 CHEMBL1204926 CHEMBL35639 CHEMBL1206579 CHEMBL1590255 CHEMBL258646 CHEMBL356512
DrugBank DB01163
ChEBI 51208
NIH Clinical Collection SAM001246687
ZINC ZINC000003830206 ZINC000013828187 ZINC000012469558 ZINC000027523506
eMolecules 29538706 30512848
IBM Patent System 2D35C6275BAD88BCEDEBFC497FE35558 C90600920AF99FEF35F0E2FD68A9B22F
FDA SRS V10579P3QZ
SureChEMBL SCHEMBL34388 SCHEMBL11236759 SCHEMBL10996500 SCHEMBL10997375 SCHEMBL10996495 SCHEMBL15668676 SCHEMBL10942366 SCHEMBL3643575 SCHEMBL10394218 SCHEMBL10997370 SCHEMBL10804599 SCHEMBL9621192 SCHEMBL8348303 SCHEMBL1981159 SCHEMBL10623793 SCHEMBL13007615 SCHEMBL34387 SCHEMBL4652732 SCHEMBL2564236 SCHEMBL11236753 SCHEMBL8575148
PharmGKB PA164754807
Human Metabolome Database HMDB0015294
PubChem: Thomson Pharma 14826403 16924511
PubChem 12877832 90118006 23704499 73291804 70477857 16760218 23620291 3084567 12877835 44282818 90660555 53393592 70544390 90660223 70544391 90660229 44282828 70447655 44282846 70488447 90660252 36273 40467053 67236157 70488640 12877833 70406864 12877834 90660254 69130011 44282830 67453552 44282829 5748616 44282817 90660227 23620290 92209245 11809654 12967761 40467054 22819935
NMRShiftDB 10022990
LINCS LSM-5528
ACToR 32887-01-7 32887-08-4
MolPort MolPort-006-069-414
Nikkaji J19.342I
EPA CompTox Dashboard DTXSID3022584
DrugCentral 1648
Brenda 16685

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