| Name |
Tetragonolide isobutyrate |
| Formula |
C25H33ClO11 |
| Mw |
544.17113961 |
| CAS RN |
119886-36-1 |
| C_ID |
C00011741
, 
|
| InChIKey |
ZDDAOLKNMGZIRJ-ZWHAMBARNA-N |
| InChICode |
InChI=1S/C25H33ClO11/c1-6-13(9-27)23(31)35-17-15-12(4)22(30)36-19(15)20(28)25(10-26)8-7-14(37-25)16(24(32)33-5)18(17)34-21(29)11(2)3/h6,11,14-20,27-28H,4,7-10H2,1-3,5H3/b13-6-/t14-,15+,16-,17-,18-,19-,20+,25-/m0/s1 |
| SMILES |
C=C1C(=O)O[C@H]2[C@H]1[C@H](OC(=O)C(=CC)CO)[C@@H](OC(=O)C(C)C)[C@@H](C(=O)OC)[C@@H]1CC[C@@](CCl)(O1)[C@@H]2O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Tetragonotheca ludoviciana | Ref. |
| Plantae | Asteraceae | Tetragonotheca repanda | Ref. |
|
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