| Name |
Daphnetoxin |
| Formula |
C27H30O8 |
| Mw |
482.19406794 |
| CAS RN |
28164-88-7 |
| C_ID |
C00003420
, 
|
| InChIKey |
LGEROVMQYFTBDI-IQVGRDBINA-N |
| InChICode |
InChI=1S/C27H30O8/c1-13(2)23-11-15(4)26-17-10-14(3)19(29)25(17,31)22(30)24(12-28)21(32-24)18(26)20(23)33-27(34-23,35-26)16-8-6-5-7-9-16/h5-10,15,17-18,20-22,28,30-31H,1,11-12H2,2-4H3/t15-,17-,18+,20-,21+,22-,23-,24+,25-,26+,27+/m1/s1 |
| SMILES |
C=C(C)[C@]12C[C@@H](C)[C@@]34OC(c5ccccc5)(O[C@@H]1[C@@H]3[C@@H]1O[C@]1(CO)[C@@H](O)[C@]1(O)C(=O)C(C)=C[C@H]14)O2 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Thymelaeaceae | Daphne mezereum  | Ref. |
|
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