(1S,2R,5R,8S,9S,10S,13R,14S,17R)-2,4,4-trideuterio-1-methoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
Compound with spectra: 1 MS (GC)
![(1S,2R,5R,8S,9S,10S,13R,14S,17R)-2,4,4-trideuterio-1-methoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one](/api/compound/IaUbvbWsE5h.png?ph=true&h=300&w=458 "(1S,2R,5R,8S,9S,10S,13R,14S,17R)-2,4,4-trideuterio-1-methoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one")
| SpectraBase Compound ID | IaUbvbWsE5h |
|---|---|
| InChI | InChI=1S/C28H48O2/c1-18(2)8-7-9-19(3)23-12-13-24-22-11-10-20-16-21(29)17-26(30-6)28(20,5)25(22)14-15-27(23,24)4/h18-20,22-26H,7-17H2,1-6H3/t19-,20-,22+,23-,24+,25+,26+,27-,28+/m1/s1/i16D2,17D/t17-,19+,20+,22-,23+,24-,25-,26-,27+,28-/m0 |
| InChIKey | ZBCKSCITMSBHBC-YIMYYTFPSA-N |
| Mol Weight | 419.7 g/mol |
| Molecular Formula | C28H45D3O2 |
| Exact Mass | 419.384261 g/mol |
| Enantiomer InChIKey | ZBCKSCITMSBHBC-OWZRJGNLSA-N |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | KC-1992-3109-20 |