etynodiol acetate Report issue

Small molecule Approved FDA
AACT ChEMBL DrugBank Drug Central KEGG MeSH PubChem

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Chemistry

Mol. Mass

300.4351

ALogP

4.43

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: C[C@]12CC[C@H]3[C@@H](CCC4=C[C@@H](O)CC[C@H]34)[C@@H]1CC[C@@]2(O)C#C
  • InChIKey: JYILPERKVHXLNF-QMNUTNMBSA-N
    1S/C20H28O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,12,14-18,21-22H,4-11H2,2H3/t14-,15-,16+,17+,18-,19-,20-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1200624   ChEMBL
ethynodiol diacetate

CHEMBL1201406   ChEMBL
ethynodiol

9E01C36A9S   NCATS
ethynodiol *

Etynodiol   Wikipedia

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