Pregna-4,6-diene-21,21-dicarboxylic acid, 17-hydroxy-3-oxo-, γ-lactone, ethyl ester, (17α)-
CAS Registry Number®
53866-20-9
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CAS Name
Pregna-4,6-diene-21,21-dicarboxylic acid, 17-hydroxy-3-oxo-, γ-lactone, ethyl ester, (17α)-Molecular Formula
C25H32O5Molecular Mass
412.52Cite this Page
Pregna-4,6-diene-21,21-dicarboxylic acid, 17-hydroxy-3-oxo-, γ-lactone, ethyl ester, (17α)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=53866-20-9 (retrieved ) (CAS RN: 53866-20-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C25H32O5/c1-4-29-21(27)18-14-25(30-22(18)28)12-9-20-17-6-5-15-13-16(26)7-10-23(15,2)19(17)8-11-24(20,25)3/h5-6,13,17-20H,4,7-12,14H2,1-3H3/t17-,18?,19+,20+,23+,24+,25-/m1/s1
InChIKey
InChIKey=UDYXOLXWRPSMNQ-GUVWBQEASA-N
SMILES
C[C@@]12[C@]3(CC(C(OCC)=O)C(=O)O3)CC[C@]1([C@]4([C@](CC2)([C@]5(C)C(C=C4)=CC(=O)CC5)[H])[H])[H]
Canonical SMILES
O=C1C=C2C=CC3C(CCC4(C)C3CCC54OC(=O)C(C(=O)OCC)C5)C2(C)CC1
Other Names for this Substance
- Pregna-4,6-diene-21,21-dicarboxylic acid, 17-hydroxy-3-oxo-, γ-lactone, ethyl ester, (17α)-
- Spiro[17H-cyclopenta[a]phenanthrene-17,2′(3′H)-furan], pregna-4,6-diene-21,21-dicarboxylic acid deriv.
