SpectraBase Compound ID | Bho0jSGwcUx |
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InChI | InChI=1S/C25H36O5/c1-14-12-25(30-22(14)28)13-24(4)16(11-20(25)27)5-6-17-18-7-8-21(29-15(2)26)23(18,3)10-9-19(17)24/h16-21,27H,1,5-13H2,2-4H3/t16-,17?,18?,19?,20+,21+,23-,24-,25-/m0/s1 |
InChIKey | CNZWSMYMDTVCMG-JCXCNXBISA-N |
Mol Weight | 416.6 g/mol |
Molecular Formula | C25H36O5 |
Exact Mass | 416.256274 g/mol |
SpectraBase Spectrum ID | JH64VhFeMmW |
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Name | 17-Acetoxyspiro[3-hydroxyandrostane-2,4'-.alpha.methylene-.gamma.-butyrolactone] |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C25H36O5 |
InChI | InChI=1S/C25H36O5/c1-14-12-25(30-22(14)28)13-24(4)16(11-20(25)27)5-6-17-18-7-8-21(29-15(2)26)23(18,3)10-9-19(17)24/h16-21,27H,1,5-13H2,2-4H3/t16-,17?,18?,19?,20+,21+,23-,24-,25-/m0/s1 |
InChIKey | CNZWSMYMDTVCMG-JCXCNXBISA-N |
Molecular Weight | 416.558 g/mol |
SMILES | O[C@]1([C@@]2(OC(=O)C(C2)=C)C[C@@]2(C3C(C4CC[C@]([C@]4(CC3)C)(OC(=O)C)[H])CC[C@]2(C1)[H])C)[H] |
SPLASH | splash10-0b91-0349600000-9ad7d3a050d0808f5693 |
Source of Spectrum | KC-0-845-10 |
Wiley ID | 824444 |