| SpectraBase Spectrum ID |
1c7KScPVYxV |
| Name |
(5Z,8R,9E,12S)-8-acetyl-9-formyl-12-hydroxy-heptadeca-5,9-dienoic acid |
| CAS Registry Number |
111219-91-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H32O5 |
| InChI |
InChI=1S/C20H32O5/c1-3-4-7-10-18(23)14-13-17(15-21)19(16(2)22)11-8-5-6-9-12-20(24)25/h5,8,13,15,18-19,23H,3-4,6-7,9-12,14H2,1-2H3,(H,24,25)/b8-5-,17-13-/t18-,19-/m0/s1 |
| InChIKey |
CTILTVLBFGFFNP-BFEDKLIESA-N |
| Molecular Weight |
352.471 g/mol |
| SMILES |
O[C@](C\C=C/([C@@](C\C=C/CCCC(=O)O)(C(=O)C)[H])C=O)(CCCCC)[H] |
| SPLASH |
splash10-0006-9000000000-2efe1c8eac3ebde15e21 |
| Source of Spectrum |
J-55-3179-3 |
| Synonyms |
(5Z,8R,9E,12S)-8-ethanoyl-9-methanoyl-12-oxidanyl-heptadeca-5,9-dienoic acid |
| Wiley ID |
1343320 |
