| SpectraBase Spectrum ID |
6kqqxzL4EpR |
| Name |
2-Butenoic acid, 2-methyl-, 2,3,3a,4,5,8,9,11a-octahydro-2-hydroxy-3,6,10-trimethylcyclodeca[b]fu ran-4-yl ester, [2R-[2R*,3S*,3aR*,4S*(Z),6E,10E,11aS*]]- |
| Alternate Name(s) |
(12R)-Hallerin
2-Hydroxy-2,3,6,10-tetramethyl-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl (2E)-2-butenoate
Cyclodeca[b]furan, 2-butenoic acid deriv.
Hallerin
Hallerin, (12R)- |
| CAS Registry Number |
88125-88-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H30O4 |
| InChI |
InChI=1S/C20H30O4/c1-6-8-18(21)23-16-11-13(2)9-7-10-14(3)12-17-19(16)15(4)20(5,22)24-17/h6,8-9,12,15-17,19,22H,7,10-11H2,1-5H3/b8-6+,13-9-,14-12- |
| InChIKey |
IJCNMTONWDOWHD-WCJQGBLMSA-N |
| Molecular Weight |
334.456 g/mol |
| SMILES |
OC1(OC2\C=C/(CC\C=C/(CC(C2C1C)OC(\C=C\C)=O)C)C)C |
| SPLASH |
splash10-053r-9030000000-79cba6d3cda7cf21c933 |
| Source of Spectrum |
KC-1983-2022-0 |
| Wiley ID |
1331113 |
![2-Butenoic acid, 2-methyl-, 2,3,3a,4,5,8,9,11a-octahydro-2-hydroxy-3,6,10-trimethylcyclodeca[b]fu ran-4-yl ester, [2R-[2R*,3S*,3aR*,4S*(Z),6E,10E,11aS*]]-](/api/spectrum/6kqqxzL4EpR/structure.png?h=300&w=458 "2-Butenoic acid, 2-methyl-, 2,3,3a,4,5,8,9,11a-octahydro-2-hydroxy-3,6,10-trimethylcyclodeca[b]fu ran-4-yl ester, [2R-[2R*,3S*,3aR*,4S*(Z),6E,10E,11aS*]]-")
