| Name |
Buddlejoside A12 |
| Formula |
C33H42O18 |
| Mw |
726.23711454 |
| CAS RN |
140187-17-3 |
| C_ID |
C00036072
, 
|
| InChIKey |
WIUPWKSKFAXVHN-FNORWQNLNA-N |
| InChICode |
InChI=1S/C33H42O18/c1-13-26(48-20(38)7-5-15-4-6-17(37)18(10-15)43-3)28(46-14(2)36)25(42)32(45-13)49-27-16-8-9-44-30(21(16)33(12-35)29(27)51-33)50-31-24(41)23(40)22(39)19(11-34)47-31/h4-10,13,16,19,21-32,34-35,37,39-42H,11-12H2,1-3H3/b7-5+/t13-,16-,19+,21-,22+,23-,24+,25+,26-,27+,28-,29-,30+,31-,32+,33+/m1/s1 |
| SMILES |
COc1cc(/C=C/C(=O)OC2C(C)OC(OC3C4C=COC(OC5OC(CO)C(O)C(O)C5O)C4C4(CO)OC34)C(O)C2OC(C)=O)ccc1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Buddlejaceae | Buddleja japonica Hemsl. | Ref. |
|
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