Estra-1,3,5(10)-trien-3-ol, 17-(1-cyclohexen-1-yloxy)-, 3-propanoate, (17β)-
CAS Registry Number®
13885-31-9
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CAS Name
Estra-1,3,5(10)-trien-3-ol, 17-(1-cyclohexen-1-yloxy)-, 3-propanoate, (17β)-Molecular Formula
C27H36O3Molecular Mass
408.57Cite this Page
Estra-1,3,5(10)-trien-3-ol, 17-(1-cyclohexen-1-yloxy)-, 3-propanoate, (17β)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=13885-31-9 (retrieved ) (CAS RN: 13885-31-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C27H36O3/c1-3-26(28)30-20-10-12-21-18(17-20)9-11-23-22(21)15-16-27(2)24(23)13-14-25(27)29-19-7-5-4-6-8-19/h7,10,12,17,22-25H,3-6,8-9,11,13-16H2,1-2H3/t22-,23-,24+,25+,27+/m1/s1
InChIKey
InChIKey=VYAXJSIVAVEVHF-RYIFMDQWSA-N
SMILES
C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=CC(OC(CC)=O)=CC4)(CC1)[H])[H])(CC[C@@H]2OC=5CCCCC5)[H]
Canonical SMILES
O=C(OC1=CC=C2C(=C1)CCC3C2CCC4(C)C(OC5=CCCCC5)CCC34)CC
Other Names for this Substance
- Estra-1,3,5(10)-trien-3-ol, 17-(1-cyclohexen-1-yloxy)-, 3-propanoate, (17β)-
- Estra-1,3,5(10)-trien-3-ol, 17β-(1-cyclohexen-1-yloxy)-, propionate
- Estra-1,3,5(10)-trien-3-ol, 17-(1-cyclohexen-1-yloxy)-, propanoate, (17β)-
- 17β-(Cyclohexen-1-yloxy)-estra-1,3,5(10)-trien-3-ol propionate
- Orestrate
