| Name |
Calein D |
| Formula |
C21H26O8 |
| Mw |
406.16276781 |
| CAS RN |
73723-67-8 |
| C_ID |
C00012309
, 
|
| InChIKey |
VPQNLDWXNPGQQT-IBTCXAGENA-N |
| InChICode |
InChI=1S/C21H26O8/c1-10(2)19(24)29-18-17(27-13(5)22)16-12(4)20(25)28-14(16)9-11(3)7-8-15(23)21(18,6)26/h7-8,11,14,16-18,26H,1,4,9H2,2-3,5-6H3/b8-7-/t11-,14+,16+,17-,18+,21-/m0/s1 |
| SMILES |
[C@H]12[C@H](OC(=O)C1=C)C[C@H](/C=C\C(=O)[C@]([C@@H]([C@H]2OC(=O)C)OC(=O)C(=C)C)(C)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Calea urticifolia | Ref. |
| Plantae | Asteraceae | Calea zacatechichi  | Ref. |
| Plantae | Asteraceae | Calea zactechichi | Ref. |
|
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