| Name |
Clibadiolide |
| Formula |
C44H58O12 |
| Mw |
778.39282732 |
| CAS RN |
116310-64-6 |
| C_ID |
C00011743
, 
|
| InChIKey |
QLBJSUHGWCUOJG-QRXVZVEQNA-N |
| InChICode |
InChI=1S/C44H58O12/c1-27(2)30(5)19-20-36(17-12-16-35(26-53-34(9)48)15-10-13-28(3)21-22-52-33(8)47)44(51)55-40-37(25-46)18-11-14-29(4)23-38-39(32(7)43(50)54-38)41(40)56-42(49)31(6)24-45/h15,17-18,21,23,25,27,38-41,45H,5-7,10-14,16,19-20,22,24,26H2,1-4,8-9H3/b28-21-,29-23+,35-15-,36-17-,37-18-/t38-,39+,40+,41-/m0/s1 |
| SMILES |
C=C(CO)C(=O)O[C@H]1[C@H]2C(=C)C(=O)O[C@@H]2/C=C(C)CC/C=C(/C=O)[C@H]1OC(=O)/C(=CCC/C(=C/CC/C(C)=CCOC(C)=O)COC(C)=O)CCC(=C)C(C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Clibadium pittierii | Ref. |
|
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