| Name |
Calein B |
| Formula |
C22H28O8 |
| Mw |
420.17841787 |
| CAS RN |
63194-23-0 |
| C_ID |
C00012307
, 
|
| InChIKey |
SQSXFUQNHWCTLO-VHMTYPHMNA-N |
| InChICode |
InChI=1S/C22H28O8/c1-7-12(3)20(25)30-19-18(28-14(5)23)17-13(4)21(26)29-15(17)10-11(2)8-9-16(24)22(19,6)27/h7-9,11,15,17-19,27H,4,10H2,1-3,5-6H3/b9-8-,12-7-/t11-,15+,17+,18-,19+,22-/m0/s1 |
| SMILES |
C=C1C(=O)O[C@@H]2C[C@@H](C)/C=CC(=O)[C@](C)(O)[C@H](OC(=O)/C(C)=CC)[C@@H](OC(C)=O)[C@@H]12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Calea zacatechichi  | Ref. |
| Plantae | Asteraceae | Calea zactechichi | Ref. |
|
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