| SpectraBase Spectrum ID |
3F3e0mwY93Y |
| Name |
4.alpha.-(2'-Pyridylthio)-18-norpodocarpa-8,11,13-trien-12-yl benzoate |
| Alternate Name(s) |
(4bS,8R)-4b,8-dimethyl-8-(2-pyridinylsulfanyl)-4b,5,6,7,8,8a,9,10-octahydro-3-phenanthrenyl benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H29NO2S |
| InChI |
InChI=1S/C28H29NO2S/c1-27-16-8-17-28(2,32-25-11-6-7-18-29-25)24(27)15-13-20-12-14-22(19-23(20)27)31-26(30)21-9-4-3-5-10-21/h3-7,9-12,14,18-19,24H,8,13,15-17H2,1-2H3/t24?,27-,28-/m1/s1 |
| InChIKey |
YIGBRPNZKUUGAJ-KUOLHFIUSA-N |
| Molecular Weight |
443.605 g/mol |
| SMILES |
[C@]12(c3c(ccc(OC(=O)c4ccccc4)c3)CCC1[C@@](Sc1ncccc1)(C)CCC2)C |
| SPLASH |
splash10-0bt9-0910000000-3feceb005a0964f04795 |
| Source of Spectrum |
B-51-657-20 |
| Wiley ID |
745782 |
