| SpectraBase Compound ID | 4k0BFFHyopU |
|---|---|
| InChI | InChI=1S/C31H39O5P/c1-30-19-17-23(32)21-22(30)13-14-26-27-15-16-29(31(27,2)20-18-28(26)30)36-37(33,34-24-9-5-3-6-10-24)35-25-11-7-4-8-12-25/h3-12,22,26-29H,13-21H2,1-2H3/t22-,26-,27-,28-,29-,30-,31-/m0/s1 |
| InChIKey | KREVWTOITIDWGI-FKVQNEAASA-N |
| Mol Weight | 522.6 g/mol |
| Molecular Formula | C31H39O5P |
| Exact Mass | 522.253511 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HpD7hrsUM9Y |
|---|---|
| Name | 17-.beta.-Hydroxy-5.alpha.-androstan-3-one Diphenyl phosphate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H39O5P |
| InChI | InChI=1S/C31H39O5P/c1-30-19-17-23(32)21-22(30)13-14-26-27-15-16-29(31(27,2)20-18-28(26)30)36-37(33,34-24-9-5-3-6-10-24)35-25-11-7-4-8-12-25/h3-12,22,26-29H,13-21H2,1-2H3/t22-,26-,27-,28-,29-,30-,31-/m0/s1 |
| InChIKey | KREVWTOITIDWGI-FKVQNEAASA-N |
| Molecular Weight | 522.622 g/mol |
| SMILES | [C@]1(OP(Oc2ccccc2)(Oc2ccccc2)=O)([C@@]2([C@@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CCC(=O)C4)C)[H])[H])([H])CC1)C)[H] |
| SPLASH | splash10-0udi-0190000000-593865818136433d8bd2 |
| Source of Spectrum | F-68-5216-21 |
| Synonyms | (5alpha,17beta)-3-oxoandrostan-17-yl diphenyl phosphate phosphoric acid[(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]diphenyl ester phosphoric acid[(5S,8R,9S,10S,13S,14S,17S)-3-keto-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]diphenyl ester [(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxidanylidene-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]diphenyl phosphate [(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]diphenyl phosphate phosphoric acid [(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] diphenyl ester [(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] diphenyl phosphate [(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxidanylidene-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] diphenyl phosphate |
| Wiley ID | 1572879 |