Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
DX4JES
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| Drug Name |
(1R,2R)-4-((8S,9S,12R,14R,17S)-3-(R)-Hydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-17-yl)-pentanoic acid 2-sulfamoyl-benzothiazol-6-yl ester
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| Synonyms |
CHEMBL3138171
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C31H44N2O5S2
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| Canonical SMILES |
C[C@H](CCC(=O)Oc1ccc2nc(sc2c1)S(=O)(=O)N)[C@H]3CC[C@H]4[C@@H]5CC[C@@H]6C[C@H](O)CC[C@]6(C)[C@H]5CC[C@]34C
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| InChI |
InChI=1S/C31H44N2O5S2/c1-18(4-11-28(35)38-21-6-10-26-27(17-21)39-29(33-26)40(32,36)37)23-8-9-24-22-7-5-19-16-20(34)12-14-30(19,2)25(22)13-15-31(23,24)3/h6,10,17-20,22-25,34H,4-5,7-9,11-16H2,1-3H3,(H2,32,36,37)/t18-,19-,20-,22+,23-,24+,25+,30+,31-/m1/s1
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| InChIKey |
MNGFBHCFZCPARZ-VQRJQWSISA-N
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| Target and Pathway | |||||
| Target(s) | Carbonic anhydrase II | Target Info | [1587926] | ||
| Carbonic anhydrase I | Target Info | [1587926] | |||
| NetPath Pathway | IL4 Signaling Pathway | ||||
| EGFR1 Signaling Pathway | |||||
| Pathway Interaction Database | C-MYB transcription factor network | ||||
| PathWhiz Pathway | Gastric Acid Production | ||||
| References | |||||
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