SpectraBase Compound ID | GZsukc6rhGK |
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InChI | InChI=1S/C20H32O3/c1-17(2)14-6-9-19-10-13(20(23,11-19)12-21)4-5-15(19)18(14,3)8-7-16(17)22/h13-15,21,23H,4-12H2,1-3H3/t13-,14-,15+,18-,19+,20+/m1/s1 |
InChIKey | MPDUJZZNNBJFAB-IPWGKGBGSA-N |
Mol Weight | 320.5 g/mol |
Molecular Formula | C20H32O3 |
Exact Mass | 320.235145 g/mol |
SpectraBase Spectrum ID | BMsWQ2fS4jB |
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Name | Abbeokutone |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C20H32O3 |
InChI | InChI=1S/C20H32O3/c1-17(2)14-6-9-19-10-13(20(23,11-19)12-21)4-5-15(19)18(14,3)8-7-16(17)22/h13-15,21,23H,4-12H2,1-3H3/t13-,14-,15+,18-,19+,20+/m1/s1 |
InChIKey | MPDUJZZNNBJFAB-IPWGKGBGSA-N |
Molecular Weight | 320.473 g/mol |
SMILES | O[C@]1(CO)C[C@]23[C@]([C@]4([C@@](C(C)(C)C(CC4)=O)(CC2)[H])C)(CC[C@@]1(C3)[H])[H] |
SPLASH | splash10-000i-0290000000-0ea5dd02945a063ce741 |
Source of Spectrum | X2-54-1129-1 |
Wiley ID | 1604173 |