| SpectraBase Spectrum ID |
LSc3VgZPe3d |
| Name |
(1'R,3'R,7S,9R)-9-fluoro-7-(3'-hydroxy-1'-methylbutoxy)-11-methoxy-9-methyl-7,8,9,10-tetrahydronaphthacene-5,12-dione |
| Alternate Name(s) |
(8R,10S)-8-fluoro-10-{[(1R,3R)-3-hydroxy-1-methylbutyl]oxy}-6-methoxy-8-methyl-7,8,9,10-tetrahydro-5,12-naphthacenedione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H27FO5 |
| InChI |
InChI=1S/C25H27FO5/c1-13(27)9-14(2)31-20-12-25(3,26)11-19-17(20)10-18-21(24(19)30-4)23(29)16-8-6-5-7-15(16)22(18)28/h5-8,10,13-14,20,27H,9,11-12H2,1-4H3/t13-,14-,20+,25-/m1/s1 |
| InChIKey |
YYHXRLDXNSORKF-GGYWXKOCSA-N |
| Molecular Weight |
426.484 g/mol |
| SMILES |
O[C@@](C[C@](O[C@@]1(c2c(c(c3c(C(=O)c4c(C3=O)cccc4)c2)OC)C[C@](C1)(F)C)[H])(C)[H])(C)[H] |
| SPLASH |
splash10-0fdo-0009000000-427381d20173baca2ee5 |
| Source of Spectrum |
JA-49-751-0 |
| Wiley ID |
1379991 |
