Estra-1,3,5(10)-triene-3,17-diol (17β)-, 17-cyclooctaneacetate
CAS Registry Number®
66791-46-6
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CAS Name
Estra-1,3,5(10)-triene-3,17-diol (17β)-, 17-cyclooctaneacetateMolecular Formula
C28H40O3Molecular Mass
424.62Cite this Page
Estra-1,3,5(10)-triene-3,17-diol (17β)-, 17-cyclooctaneacetate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=66791-46-6 (retrieved ) (CAS RN: 66791-46-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C28H40O3/c1-28-16-15-23-22-12-10-21(29)18-20(22)9-11-24(23)25(28)13-14-26(28)31-27(30)17-19-7-5-3-2-4-6-8-19/h10,12,18-19,23-26,29H,2-9,11,13-17H2,1H3/t23-,24-,25+,26+,28+/m1/s1
InChIKey
InChIKey=CZCGBAHDFURTGU-VMBLQBCYSA-N
SMILES
C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=CC(O)=CC4)(CC1)[H])[H])(CC[C@@H]2OC(CC5CCCCCCC5)=O)[H]
Canonical SMILES
O=C(OC1CCC2C3CCC4=CC(O)=CC=C4C3CCC12C)CC5CCCCCCC5
Other Names for this Substance
- Estra-1,3,5(10)-triene-3,17-diol (17β)-, 17-cyclooctaneacetate
- Estradiol 17β-cyclooctylacetate
