| SpectraBase Spectrum ID |
3ZTJH8dkXcr |
| Name |
1-Hydroxy-17-(1-oxoethyl)-2-oxa-androst-4-en-3-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H28O4 |
| InChI |
InChI=1S/C20H28O4/c1-11(21)14-6-7-15-13-5-4-12-10-17(22)24-18(23)20(12,3)16(13)8-9-19(14,15)2/h10,13-16,18,23H,4-9H2,1-3H3/t13-,14?,15-,16-,18?,19+,20-/m0/s1 |
| InChIKey |
NRBOTVJSWLTFCB-IDNDPUPQSA-N |
| Molecular Weight |
332.440 g/mol |
| SMILES |
OC1[C@]2(C(=CC(O1)=O)CC[C@]1([C@@]3(CCC([C@]3(CC[C@]21[H])C)C(=O)C)[H])[H])C |
| SPLASH |
splash10-000i-0090000000-8b4585b7d881f401c1e3 |
| Source of Spectrum |
F-47-8369-19 |
| Synonyms |
(4aR,4bS,6aS,9aS,9bS)-7-acetyl-4-hydroxy-4a,6a-dimethyl-4a,4b,5,6,6a,7,8,9,9a,9b,10,11-dodecahydrocyclopenta[5,6]naphtho[1,2-c]pyran-2(4H)-one |
| Wiley ID |
1329631 |
