| Name |
Bargustanine |
| Formula |
C29H34N2O7 |
| Mw |
522.23660146 |
| CAS RN |
169626-12-4 |
| C_ID |
C00027521
, 
|
| InChIKey |
AYINLWLMPMZNKE-OBXPXUJENA-N |
| InChICode |
InChI=1S/C29H34N2O7/c1-30-9-7-16-12-22(36-3)23(14-19(16)15-30)38-29-25-17(13-24(37-4)28(29)35)8-10-31(2)26(25)27(34)18-5-6-20(32)21(33)11-18/h5-6,11-14,26-27,32-35H,7-10,15H2,1-4H3/t26-,27-/m1/s1 |
| SMILES |
Oc1cc(ccc1O)[C@H]([C@H]1c2c(CCN1C)cc(c(c2Oc1c(cc2CCN(Cc2c1)C)OC)O)OC)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Tyr |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Berberidaceae | Berberis vulgaris  | Ref. |
|
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