| SpectraBase Spectrum ID |
3gx8aZg6JSs |
| Name |
(+/-)-Penicillone A |
| Alternate Name(s) |
8-Hydroxy-5,6,8-trimethylhexahydro-1,6-methanonaphthalene-2,7,9(1H,3H)-trione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18O4 |
| InChI |
InChI=1S/C14H18O4/c1-6-7-4-5-8(15)9-10(7)14(3,18)12(17)13(6,2)11(9)16/h6-7,9-10,18H,4-5H2,1-3H3/t6-,7-,9-,10+,13-,14+/m0/s1 |
| InChIKey |
DNVZKCLFZKHNIP-YNEPJRCTSA-N |
| Literature Reference DOI |
10.1021/ol702062p |
| Molecular Weight |
250.294 g/mol |
| SMILES |
O[C@@]1(C)C([C@@]2(C(=O)[C@]3(C(CC[C@]([C@@]13[H])([C@@]2(C)[H])[H])=O)[H])C)=O |
| SPLASH |
splash10-00g0-1930000000-e4f40948feb71e459836 |
| Source of Spectrum |
A1-9-4563/SMS9-1 |
| Wiley ID |
1758717 |
