(17β)-3,17-Bis[(1-oxopentyl)oxy]estra-1,3,5(10)-trien-6-one
CAS Registry Number®
1350468-78-8
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CAS Name
(17β)-3,17-Bis[(1-oxopentyl)oxy]estra-1,3,5(10)-trien-6-oneMolecular Formula
C28H38O5Molecular Mass
454.60Cite this Page
(17β)-3,17-Bis[(1-oxopentyl)oxy]estra-1,3,5(10)-trien-6-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1350468-78-8 (retrieved ) (CAS RN: 1350468-78-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C28H38O5/c1-4-6-8-26(30)32-18-10-11-19-20-14-15-28(3)23(21(20)17-24(29)22(19)16-18)12-13-25(28)33-27(31)9-7-5-2/h10-11,16,20-21,23,25H,4-9,12-15,17H2,1-3H3/t20-,21-,23+,25+,28+/m1/s1
InChIKey
InChIKey=MGZAGEZPKGTPRU-RNRUCVIISA-N
SMILES
C[C@@]12[C@]([C@]3([C@@](C=4C(C(=O)C3)=CC(OC(CCCC)=O)=CC4)(CC1)[H])[H])(CC[C@@H]2OC(CCCC)=O)[H]
Canonical SMILES
O=C(OC1=CC=C2C(=C1)C(=O)CC3C2CCC4(C)C(OC(=O)CCCC)CCC34)CCCC
Other Names for this Substance
- Estra-1,3,5(10)-trien-6-one, 3,17-bis[(1-oxopentyl)oxy]-, (17β)-
- (17β)-3,17-Bis[(1-oxopentyl)oxy]estra-1,3,5(10)-trien-6-one