| SpectraBase Spectrum ID |
IkLFpddE0i8 |
| Name |
(1S,4aR,8aR)-8-[(E)-3-(3-furanyl)-1-oxoprop-2-enyl]-1,4a,7,8a-tetramethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester |
| Alternate Name(s) |
(1S,4aR,8aR)-8-[(E)-3-(3-furyl)acryloyl]-1,4a,7,8a-tetramethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester
Methyl (1S,4aR,8aR)-8-[(E)-3-(3-furyl)prop-2-enoyl]-1,4a,7,8a-tetramethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
Methyl (1S,4aR,8aR)-8-[(E)-3-(furan-3-yl)prop-2-enoyl]-1,4a,7,8a-tetramethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H36O4 |
| InChI |
InChI=1S/C27H36O4/c1-18-7-10-21-25(2)13-6-14-27(4,24(29)30-5)22(25)11-15-26(21,3)23(18)20(28)9-8-19-12-16-31-17-19/h8-9,12,16-17,21-22H,6-7,10-11,13-15H2,1-5H3/b9-8+/t21?,22?,25-,26-,27+/m1/s1 |
| InChIKey |
YQKFQMHABFTTDE-QZKNWPQZSA-N |
| Molecular Weight |
424.581 g/mol |
| SMILES |
[C@@]12(C(=C(C)CCC1[C@]1(CCC[C@@](C1CC2)(C(=O)OC)C)C)C(\C=C\c1cocc1)=O)C |
| SPLASH |
splash10-00e9-6932400000-f0265644adfe87062b09 |
| Source of Spectrum |
F-53-14137-6 |
| Wiley ID |
804062 |
![(1S,4aR,8aR)-8-[(E)-3-(3-furanyl)-1-oxoprop-2-enyl]-1,4a,7,8a-tetramethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester](/api/spectrum/IkLFpddE0i8/structure.png?h=300&w=458 "(1S,4aR,8aR)-8-[(E)-3-(3-furanyl)-1-oxoprop-2-enyl]-1,4a,7,8a-tetramethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester")
