SpectraBase Spectrum ID |
KmAAoli6kA7 |
Name |
17,18-Didehydro-11,15-O-bis(tetrahydropyran-2-yl)-PGE3 methyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C31H46O7 |
InChI |
InChI=1S/C31H46O7/c1-3-4-7-14-24(37-30-17-10-12-21-35-30)19-20-26-25(15-8-5-6-9-16-29(33)34-2)27(32)23-28(26)38-31-18-11-13-22-36-31/h5,8,19-20,24-26,28,30-31H,3,6,9-18,21-23H2,1-2H3/b8-5+,20-19+/t24?,25-,26-,28-,30?,31?/m1/s1 |
InChIKey |
XOKXUDAWIFSDLI-DITHPFFISA-N |
Molecular Weight |
530.702 g/mol |
SMILES |
[C@]1([C@](\C=C\C(OC2OCCCC2)CC#CCC)([C@@](C\C=C\CCCC(=O)OC)(C(C1)=O)[H])[H])(OC1OCCCC1)[H] |
SPLASH |
splash10-004i-0098100000-d6ce27bc5a7a8ff84542 |
Source of Spectrum |
F-48-1978-12 |
Synonyms |
(E)-7-{(1R,2R,3R)-5-Oxo-3-(tetrahydro-pyran-2-yloxy)-2-[(E)-3-(tetrahydro-pyran-2-yloxy)-oct-1-en-5-ynyl]-cyclopentyl}-hept-5-enoic acid methyl ester
Methyl (5E,11beta,13E)-9-oxo-11,15-bis(tetrahydro-2H-pyran-2-yloxy)prosta-5,13-dien-17-yn-1-oate |
Wiley ID |
1403365 |