ChEMBL logo

ChEMBL

spacer
ChEMBL Statistics
  Loading Statistics...
spacer

UniChem Connectivity Layer Cross References

Legend

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

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



Source Identical Component s i p si ip sp sip
ChEMBL CHEMBL2105613 CHEMBL109
DrugBank DB00313
PDBe 2PP NA
Guide to Pharmacology 7009
PubChem: Drugs of the Future 12013303 12015354
KEGG Ligand C07185 C01330
ChEBI 4667 39867 60654 29101
NIH Clinical Collection SAM002564230
ZINC ZINC000003008621
eMolecules 32278126 593399 519280 10523415
IBM Patent System 9EF20D0A4E28DF158132347114C18E17 BEF96C09E74355F2FB716BA431A7F837
Atlas valproic acid
FDA SRS 644VL95AO6 614OI1Z5WI LYR4M0NH37 18HB6B1L37 UR0T0B24E9
SureChEMBL SCHEMBL40996 SCHEMBL2275 SCHEMBL157767 SCHEMBL8333713 SCHEMBL27657 SCHEMBL795762 SCHEMBL2789078 SCHEMBL7787359 SCHEMBL796614 SCHEMBL17061415 SCHEMBL7789633 SCHEMBL7781969 SCHEMBL796630 SCHEMBL7786602 SCHEMBL7786936 SCHEMBL7786603 SCHEMBL1330837 SCHEMBL7781978
PharmGKB PA164783479 PA451846
Human Metabolome Database HMDB0001877 HMDB0000588
Selleck Divalproex-sodium
PubChem: Thomson Pharma 16653561 15321539 15119549 96069784 96069778 99210712 99210426 99210425 96069783 96069781 99210421 99210424 96069782 96069776 96069777 99210713 96069780 99210422 96069779 99210428 99210423 96054946 99210427 16747182 14776622
PubChem 23663956 22227467 3121 3549980 21863552 20429074 923 22461840 46215394 88202300 46215399 87158683 46832833 46832539 76973098 91384429 87158809 46209523 12429180 46832537 46215398 118353291 46832538 71308961 131953166 46215395 46832541 46832540 46215393 46832834 46832535 46215396 46200988 87158811 159148 46215392 11643942 46832536 88202175 46215397 71587008 71587009 123133598 9818208
Mcule MCULE-7136317196 MCULE-3833394421
NMRShiftDB 20200678
LINCS LSM-4620
ACToR 76584-70-8 99-66-1 17341-25-2 87745-18-4
Recon na1
MolPort MolPort-006-167-562 MolPort-001-791-895 MolPort-046-069-029 MolPort-003-850-831
Nikkaji J4.972G J1.085.483K
BindingDB 50009834 50003616
EPA CompTox Dashboard DTXSID70227388 DTXSID6023733 DTXSID8037671 DTXSID00236605 DTXSID10168327 DTXSID70168328
LipidMaps LMFA01020291
DrugCentral 2803
Metabolights MTBLC29101
Brenda 105944 107471 6032 2424 104648 202694 202693 48043 208285 208284 208283 59 1602 48042 135834 2375 208282 202160
Rhea 29101
ChemicalBook CB4149527 CB7149528

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/key_search/MSRILKIQRXUYCT-UHFFFAOYSA-M/0/0/4
spacer
spacer