| SpectraBase Spectrum ID |
FzQ73BAyYHy |
| Name |
20Beta,21-dihydroxypregn-4-en-3-one, 21-(methyl carbonate) |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
390.240624190 u |
| Formula |
C23H34O5 |
| InChI |
InChI=1S/C23H34O5/c1-22-10-8-15(24)12-14(22)4-5-16-17-6-7-19(20(25)13-28-21(26)27-3)23(17,2)11-9-18(16)22/h12,16-20,25H,4-11,13H2,1-3H3/t16-,17-,18-,19+,20+,22-,23-/m0/s1 |
| InChIKey |
COKZBYNJEDXNGT-UMDFJOQQSA-N |
| Molecular Weight |
390.520 g/mol |
| SMILES |
O[C@@]([C@]1(CC[C@]2([C@@]3(CCC4=CC(CC[C@@]4([C@]3(CC[C@]12C)[H])C)=O)[H])[H])[H])(COC(OC)=O)[H] |
