![(2S,8R,9S,10S,13S,14S)-13-methyl-2-oxidanyl-3,17-bis(oxidanylidene)-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde](/api/spectrum/5fXhPXFzHT4/structure.png?h=300&w=458 "(2S,8R,9S,10S,13S,14S)-13-methyl-2-oxidanyl-3,17-bis(oxidanylidene)-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde")
| SpectraBase Compound ID | EXtEoYwQwF0 |
|---|---|
| InChI | InChI=1S/C19H24O4/c1-18-7-6-14-12(13(18)4-5-17(18)23)3-2-11-8-15(21)16(22)9-19(11,14)10-20/h8,10,12-14,16,22H,2-7,9H2,1H3/t12-,13-,14-,16-,18-,19+/m0/s1 |
| InChIKey | PTGIVKYRXURANS-GZOOHYFNSA-N |
| Mol Weight | 316.4 g/mol |
| Molecular Formula | C19H24O4 |
| Exact Mass | 316.167459 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5fXhPXFzHT4 |
|---|---|
| Name | (2S,8R,9S,10S,13S,14S)-13-methyl-2-oxidanyl-3,17-bis(oxidanylidene)-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H24O4 |
| InChI | InChI=1S/C19H24O4/c1-18-7-6-14-12(13(18)4-5-17(18)23)3-2-11-8-15(21)16(22)9-19(11,14)10-20/h8,10,12-14,16,22H,2-7,9H2,1H3/t12-,13-,14-,16-,18-,19+/m0/s1 |
| InChIKey | PTGIVKYRXURANS-GZOOHYFNSA-N |
| Molecular Weight | 316.397 g/mol |
| SMILES | O[C@@]1(C(C=C2CC[C@]3([C@@]4(CCC([C@@]4(C)CC[C@@]3([C@]2(C1)C=O)[H])=O)[H])[H])=O)[H] |
| SPLASH | splash10-00rl-0092000000-4fc600a31819cd5bba06 |
| Source of Spectrum | Y1-32-233-2 |
| Synonyms | (2S,8R,9S,10S,13S,14S)-2-hydroxy-13-methyl-3,17-dioxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde (2S,8R,9S,10S,13S,14S)-2-hydroxy-13-methyl-3,17-dioxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-10-carboxaldehyde (2S,8R,9S,10S,13S,14S)-2-hydroxy-3,17-diketo-13-methyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde |
| Wiley ID | 1525989 |