SpectraBase Spectrum ID |
9ujn2s4ECpg |
Name |
Ethyl (2R,3R,5S,8S,9S)-3,8,9-trihydroxy-2,5-dimethyltetradec-12-ynoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H32O5 |
InChI |
InChI=1S/C18H32O5/c1-5-7-8-9-15(19)16(20)11-10-13(3)12-17(21)14(4)18(22)23-6-2/h13-17,19-21H,6,8-12H2,1-4H3/t13-,14+,15-,16-,17+/m0/s1 |
InChIKey |
WXOFPYZDCQWQSZ-BQJWPVKWSA-N |
Literature Reference DOI |
10.1002/anie.201106117 |
Molecular Weight |
328.449 g/mol |
SMILES |
O[C@]([C@](CC[C@](C)(C[C@@](O)([C@@](C)(C(OCC)=O)[H])[H])[H])(O)[H])(CCC#CC)[H] |
SPLASH |
splash10-03di-5950000000-8d870097386763aacb67 |
Source of Spectrum |
ACI-50-SMS14-S7 |
Wiley ID |
1780166 |