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UniChem Connectivity Layer Cross References

Legend

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

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



Source Identical Component s i p si ip sp sip
ChEMBL CHEMBL1323 CHEMBL1201127 CHEMBL262307 CHEMBL179266 CHEMBL175231
DrugBank DB01264
PDBe 017
PubChem: Drugs of the Future 12015589
ChEBI 367163
ZINC ZINC000003955219 ZINC000271773410 ZINC000271773416 ZINC000271773397 ZINC000028094626 ZINC000028117859 ZINC000669678981 ZINC000028095885 ZINC000271773404
eMolecules 35833368 36557635 36027108 36752572
IBM Patent System E7659B947667B3090BA7ED25930D615C BB942B308C08094DA6DCEB6BE847A891 095CDD083C9FC3113BA00C82A64FE0C8 1B8655E5B7ABDB73A66005DB2BD2E333 414B3CEA1BB49B2E3E130C925F425D87 100D7BDF7B350BD57EE3D00C053A6710 B021B9319EE669126955DC1C4869434F 375FD8BBAD33788A2B67EF51E2889F9D 2DC478FC4BE4BE37E34803D2C7F954CD
FDA SRS YO603Y8113 33O78XF0BW KPC4NRB25L
SureChEMBL SCHEMBL562454 SCHEMBL17210129 SCHEMBL118546 SCHEMBL15443113 SCHEMBL2030032 SCHEMBL15129269 SCHEMBL15129144 SCHEMBL2221218 SCHEMBL12574003 SCHEMBL14421346 SCHEMBL7821979 SCHEMBL16920048 SCHEMBL16920046 SCHEMBL16920047 SCHEMBL1272992 SCHEMBL12574000 SCHEMBL8274337 SCHEMBL562633 SCHEMBL14652382 SCHEMBL3009075 SCHEMBL20239097 SCHEMBL13328575 SCHEMBL13328526 SCHEMBL13328574 SCHEMBL13328572 SCHEMBL13328573
PharmGKB PA163522472
Human Metabolome Database HMDB0015393
Selleck Darunavir-Ethanolate(Prezista)
PubChem: Thomson Pharma 16768894 131467684 14788134 81075446 99230057 56454426 136329027 124400348 16725185 17160921 16566910 16285451 144119551 16445019 96048320 96049588 96047925 96049029 96049860 58104980 96049440 96048032 96049599 96048166 96048881 58105688 96048571 58105337 96048741 125264949 96049027 58105339 96049026 96048054 96048437 96049859 96048451 96048436 96047904 96047923 96048587 96048188 96047796 96048303 96048452 96047903 96048729 96048742 96047902 96048601 96048185 96048730 96047924 96049445 96049028 96048187 96048301 58104634 96048053 96048439 96048739 96049574 96048588 96048731 96048186 96048165 96048164 96048455 96048031 57414755 96048880 96047773 96048454 58104983 96048590 96049858 92756223 96048051 96049434 96048448 96048591 117689786 96049575 58104981 96047905 96047774 96048033 96048322 96048302 117689880 96048300 96048453 96048438 96049727 96047797 96047922 96048740 96048034 96048882 96047775 96048450 58105685 96048589 58105338 58100555 96048052 96047776 96048167 96048449 96048321 96048323 58090145 58090246 58090142 58090247 117690082 117689879 58090144 117689974 58090042 117690081 117689975 117690080 58090143 117689973 117689881
PubChem 46843267 54724697 91971516 23725083 73053375 86761153 54671213 42636391 86676098 213039 71696449 71657840 71666655 131743160 89704725 90718247 53259004 57327017 71666654 91971971 71666656 73415779 67253813 86660515 71666657 11982895 11848139 125136515 58330571 89334570 129010372 102206609 102206608 102206607 44578485 118243427 134694393 129010371 118243429 131632443 118243428 6320436 70329566 6320435 131667685 101897907 125136514 131706260 66725685 60170302 52949690 134694394 23545473 89394603 6320437 44400512 46195226 51029883 46196048 25270909 59317347 46194125 46194513 46195079 46194355 46195633 25270210 46195781 46194770 76973674 46194940 25270565 53362102 46195224 46195767 25270567 46195223 46194251 46194632 46196047 46194646 46195792 46194229 46194786 46194123 46194378 46193995 46194800 46194494 46194647 46194100 46194928 46194941 46194099 46194375 25269886 46195638 46194124 46195225 46194101 46194631 46194929 46194377 46194250 46194634 46194938 46194492 46194787 46193996 46194354 57696395 46194353 46194650 46194789 46194930 46194376 46194649 25270213 25207700 46194228 46196046 124017204 45273884 46194790 46194248 46195627 46194643 51029791 46193973 46195768 25270211 51029792 46194102 46193972 46195078 46194491 51029882 46194648 46195080 46193974 46194493 46194633 46194122 46194939 46194231 46195917 46193975 46194356 46194788 25270906 25270566 46194515 46194230 59317329 46194645 46194644 46194514 46194249 25265814 46194516 25256051 25256153 25256050 25256048 25256154 51030070 51029880 51030069 51029971 25255947 51029881 51030068 51029972 51030067 25256049 51029970 51029884
LINCS LSM-45520
ACToR 618109-00-5 206361-99-1 635728-39-1 635728-49-3
MolPort MolPort-003-846-141 MolPort-028-744-950 MolPort-003-846-142
Nikkaji J2.037.394F J2.151.446B J2.151.444F J2.151.442J J2.151.445D J2.151.440C J2.151.441A J2.151.443H J3.373.031D
BindingDB 8125
EPA CompTox Dashboard DTXSID0046779 DTXSID30212957
DrugCentral 4143
Brenda 1901 164284 164283 23670
ChemicalBook CB51176244 CB32496602

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