| Name |
Dracotanoside B
(-)-Dracotanoside B |
| Formula |
C44H55N3O13 |
| Mw |
833.37348887 |
| CAS RN |
1165808-44-5 |
| C_ID |
C00047439
, 
|
| InChIKey |
HEYPIXYGEMJYSY-QPYWSSLDNA-N |
| InChICode |
InChI=1S/C44H55N3O13/c1-27-36(50)39(53)41(60-43-40(54)38(52)37(51)33(59-43)26-56-42(55)30-13-6-3-7-14-30)44(57-27)58-31-18-16-29(17-19-31)32-25-34(48)46-22-10-24-47(23-9-8-21-45-32)35(49)20-15-28-11-4-2-5-12-28/h2-7,11-20,27,32-33,36-41,43-45,50-54H,8-10,21-26H2,1H3,(H,46,48)/b20-15+/t27-,32-,33+,36-,37-,38-,39+,40+,41+,43-,44-/m0/s1 |
| SMILES |
C[C@@H]1O[C@@H](Oc2ccc([C@@H]3CC(=O)NCCCN(C(=O)/C=C/c4ccccc4)CCCCN3)cc2)[C@H](O[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp L-Lys |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Dracocephalum tanguricum | Ref. |
|
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