| SpectraBase Spectrum ID |
HJDG6oSIJQ1 |
| Name |
3-Acetoxy-17.alpha.-pregna-2,4,6-triene-21,17-carbolactone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H30O4 |
| InChI |
InChI=1S/C24H30O4/c1-15(25)27-17-6-10-22(2)16(14-17)4-5-18-19(22)7-11-23(3)20(18)8-12-24(23)13-9-21(26)28-24/h4-6,14,18-20H,7-13H2,1-3H3/t18?,19-,20-,22-,23-,24+/m0/s1 |
| InChIKey |
UGEVHXDXILVFRI-DNKFGTHDSA-N |
| Molecular Weight |
382.500 g/mol |
| SMILES |
[C@@]12(C(=CC(=CC2)OC(=O)C)C=CC2[C@@]1(CC[C@@]1([C@@]3(OC(=O)CC3)CC[C@@]21[H])C)[H])C |
| SPLASH |
splash10-0006-0009000000-8a503c877f80120979fb |
| Source of Spectrum |
D8-328-163-3 |
| Wiley ID |
1515662 |
