Drug General Information
Drug ID
DXX3LT
Drug Name
Adociasulfate-2
Synonyms
Adociasulfate-2; CHEMBL426141
Indication Discovery agent Investigative [1587926]
Formula
C36H52Na2O9S2
Canonical SMILES
[Na+].[Na+].CC1(C)CCC[C@]2(C)O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC[C@@]6(C)[C@H]5Cc7c(OS(=O)(=O)[O-])ccc(OS(=O)(=O)[O-])c67)[C@]3(C)CC[C@@H]12
InChI
InChI=1S/C36H54O9S2.2Na/c1-31(2)15-8-16-36(7)25(31)11-18-34(5)27-12-17-33(4)26(32(27,3)20-14-29(34)43-36)13-19-35(6)28(33)21-22-23(44-46(37,38)39)9-10-24(30(22)35)45-47(40,41)42;;/h9-10,25-29H,8,11-21H2,1-7H3,(H,37,38,39)(H,40,41,42);;/q;2*+1/p-2/t25-,26+,27+,28-,29-,32+,33+,34-,35-,36-;;/m0../s1
InChIKey
LLFWGACFIWPWDA-TZYHAVDYSA-L
Target and Pathway
Target(s) Kinesin-like protein KIF11 Target Info [1587926]
mRNA of kinesin spindle protein Target Info [1587926]
Reactome MHC class II antigen presentation
KinesinsR-HSA-2132295:MHC class II antigen presentation
Kinesins
WikiPathways MHC class II antigen presentation
KinesinsWP2679:MHC class II antigen presentation
Kinesins
References
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017

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