Drug Information
Drug General Information | Top | |||
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Drug ID |
D02MZN
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Former ID |
DNC006155
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Drug Name |
N-N-diethyl estradiol-16-methyl carboxamide
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Synonyms |
SCHEMBL12379569
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Drug Type |
Small molecular drug
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Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
Structure |
Download2D MOL |
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Formula |
C24H35NO3
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Canonical SMILES |
CCN(CC)C(=O)CC1CC2C3CCC4=C(C3CCC2(C1O)C)C=CC(=C4)O
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InChI |
1S/C24H35NO3/c1-4-25(5-2)22(27)14-16-13-21-20-8-6-15-12-17(26)7-9-18(15)19(20)10-11-24(21,3)23(16)28/h7,9,12,16,19-21,23,26,28H,4-6,8,10-11,13-14H2,1-3H3/t16?,19?,20?,21?,23-,24-/m0/s1
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InChIKey |
VGGFHJKLCAAIOU-CGCZFLRESA-N
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PubChem Compound ID |
Target and Pathway | Top | |||
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Target(s) | Estradiol 17 beta-dehydrogenase 1 (17-beta-HSD1) | Target Info | Inhibitor | [1] |
BioCyc | Superpathway of steroid hormone biosynthesis | |||
Estradiol biosynthesis I | ||||
KEGG Pathway | Steroid hormone biosynthesis | |||
Metabolic pathways | ||||
Ovarian steroidogenesis | ||||
NetPath Pathway | FSH Signaling Pathway | |||
Panther Pathway | Androgen/estrogene/progesterone biosynthesis | |||
Pathwhiz Pathway | Androgen and Estrogen Metabolism | |||
Reactome | The canonical retinoid cycle in rods (twilight vision) | |||
WikiPathways | Steroid Biosynthesis | |||
Metabolism of steroid hormones and vitamin D | ||||
Prostate Cancer |
References | Top | |||
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REF 1 | Modification of estrone at the 6, 16, and 17 positions: novel potent inhibitors of 17beta-hydroxysteroid dehydrogenase type 1. J Med Chem. 2006 Feb 23;49(4):1325-45. |
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