SpectraBase Compound ID | 9w5lIpGk5fa |
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InChI | InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18-,19+/m0/s1/i21D |
InChIKey | PXGPLTODNUVGFL-NRDLTNKTSA-N |
Mol Weight | 355.5 g/mol |
Molecular Formula | C20H332DO5 |
Exact Mass | 355.246901 g/mol |
SpectraBase Spectrum ID | EfpFfSlIYGF |
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Name | 9.alpha.,11.alpha.,15.alpha.-Trihydroxy-15-deutero-5-cis,13-trans-prostadienoic acid |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C20H33DO5 |
InChI | InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18-,19+/m0/s1/i21D |
InChIKey | PXGPLTODNUVGFL-NRDLTNKTSA-N |
Molecular Weight | 355.493 g/mol |
SMILES | O[C@]1(C[C@]([C@@]([C@]1(C\C=C/CCCC(=O)O)[H])(\C=C\[C@@](O[2D])(CCCCC)[H])[H])(O)[H])[H] |
SPLASH | splash10-014i-3592000000-fdb2d92790d5b478aa1a |
Source of Spectrum | BS-5-138-0 |
Wiley ID | 1344642 |