SpectraBase Spectrum ID |
9PsJWQoH8d6 |
Name |
Pregn-5-ene-20-carbonitrile, 20-(acetyldioxy)-3,3-[1,2-ethanediylbis(oxy)]- |
Alternate Name(s) |
1-cyano-1-[(1'S,2'R,10'S,11'S,14'S,15'S)-2',15'-dimethylspiro[1,3-dioxolane-2,5'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan]-7'-en-14'-yl]ethyl ethaneperoxoate
20-Carbonitrile-20-peracetoxypregn-5-en-3-one-ethylene ketal |
CAS Registry Number |
62623-52-3 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H37NO5 |
InChI |
InChI=1S/C26H37NO5/c1-17(28)31-32-25(4,16-27)22-8-7-20-19-6-5-18-15-26(29-13-14-30-26)12-11-23(18,2)21(19)9-10-24(20,22)3/h5,19-22H,6-15H2,1-4H3/t19-,20-,21-,22-,23-,24-,25?/m0/s1 |
InChIKey |
HUYKIRSAXLKPIO-XEASAFCRSA-N |
Molecular Weight |
443.584 g/mol |
SMILES |
[C@@]12([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CCC2(OCCO2)C4)C)[H])(CC[C@@]1(C(C#N)(OOC(=O)C)C)[H])[H])C |
SPLASH |
splash10-0002-9602000000-1ca4c17de211ea862211 |
Source of Spectrum |
C-99-1541-0 |
Wiley ID |
1385764 |