| SpectraBase Spectrum ID |
5kTecZLuDD1 |
| Name |
(7R,10S,13R,14R)-7-(Methoxycarbonyl)-8,9-dehydro-17-nor-5,6-seco-spongian-15-one |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O4 |
| InChI |
InChI=1S/C21H32O4/c1-13(18(22)24-5)16-15(8-7-14-11-25-19(23)17(14)16)21(4)10-6-9-20(2,3)12-21/h13-14,17H,6-12H2,1-5H3/t13-,14+,17-,21+/m1/s1 |
| InChIKey |
KJWLJWDXAGRMKP-XGHMHFBMSA-N |
| Molecular Weight |
348.483 g/mol |
| SMILES |
C1(=C([C@@]2(CC(C)(C)CCC2)C)CC[C@@]2([C@]1(C(OC2)=O)[H])[H])[C@](C(=O)OC)(C)[H] |
| SPLASH |
splash10-01b9-0049000000-f310143bf6f15bd873b5 |
| Source of Spectrum |
KC-60-1077-6 |
| Synonyms |
(2R)-2-[(3aR,7aR)-3-oxo-5-[(1S)-1,3,3-trimethylcyclohexyl]-3a,6,7,7a-tetrahydro-1H-isobenzofuran-4-yl]propanoic acid methyl ester
Methyl (2R)-2-[(3aR,7aR)-3-oxo-5-[(1S)-1,3,3-trimethylcyclohexyl]-3a,6,7,7a-tetrahydro-1H-2-benzofuran-4-yl]propanoate
Methyl (2R)-2-[(3aR,7aR)-3-oxo-5-[(1S)-1,3,3-trimethylcyclohexyl]-3a,6,7,7a-tetrahydro-1H-isobenzofuran-4-yl]propanoate
Methyl (2R)-2-[(3aR,7aR)-3-oxidanylidene-5-[(1S)-1,3,3-trimethylcyclohexyl]-3a,6,7,7a-tetrahydro-1H-2-benzofuran-4-yl]propanoate |
| Wiley ID |
1583233 |
