Drug Information
| Drug General Information | |||||
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| Drug ID |
DXJ9TW
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| Drug Name |
1-{4-[4,5-Dihydroxy-6-hydroxymethyl-3,4,5,6-tetramethyl-3-(3,4,5-trihydroxy-2,4,5,6,6-pentamethyl-tetrahydro-pyran-2-yloxy)-tetrahydro-pyran-2-yloxy]-2,6-dihydroxy-phenyl}-3-(3-hydroxy-4-methoxy-phenyl)-propan-1-one
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| Synonyms |
CHEMBL2029061
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C36H52O15
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| Canonical SMILES |
COc1ccc(CCC(=O)c2c(O)cc(OC3O[C@@](C)(CO)[C@@](C)(O)[C@](C)(O)[C@]3(C)O[C@]4(C)OC(C)(C)[C@](C)(O)[C@](C)(O)[C@H]4O)cc2O)cc1O
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| InChI |
InChI=1S/C36H52O15/c1-29(2)34(7,44)31(4,43)27(42)33(6,50-29)51-32(5)28(49-30(3,18-37)35(8,45)36(32,9)46)48-20-16-23(40)26(24(41)17-20)21(38)13-11-19-12-14-25(47-10)22(39)15-19/h12,14-17,27-28,37,39-46H,11,13,18H2,1-10H3/t27-,28?,30+,31-,32-,33+,34+,35-,36-/m1/s1
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| InChIKey |
CHXGEQWNFRZIOC-KODDFXDSSA-N
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| Target and Pathway | |||||
| Target(s) | 3-oxo-5-alpha-steroid 4-dehydrogenase 1 | Target Info | [1587926] | ||
| 3-oxo-5-alpha-steroid 4-dehydrogenase 2 | Target Info | [1587926] | |||
| NetPath Pathway | IL2 Signaling Pathway | ||||
| PathWhiz Pathway | Androgen and Estrogen Metabolism | ||||
| References | |||||
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