SpectraBase Spectrum ID |
GG6GvqtdKHW |
Name |
Isolachnellulone |
CAS Registry Number |
116837-88-8 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H28O5 |
InChI |
InChI=1S/C18H28O5/c1-3-5-7-9-14-16(19)17(20)15(18(21)23-14)13-11-10-12(22-13)8-6-4-2/h12,14,16,19H,3-11H2,1-2H3/b15-13+/t12?,14-,16+/m0/s1 |
InChIKey |
XUXPQZIAHQAQKO-MQVOGQFXSA-N |
Molecular Weight |
324.417 g/mol |
SMILES |
O[C@]1(C(\C(C(O[C@]1(CCCCC)[H])=O)=C\1OC(CCCC)CC1)=O)[H] |
SPLASH |
splash10-00di-0390000000-6f86ea45cde9640a80da |
Source of Spectrum |
I-66-511-0 |
Synonyms |
(3E,5R,6S)-3-(5-butyldihydro-2(3H)-furanylidene)-5-hydroxy-6-pentyldihydro-2H-pyran-2,4(3H)-dione |
Wiley ID |
1323218 |