| Name |
Prebetanin |
| Formula |
C24H26N2O16S |
| Mw |
630.10030353 |
| CAS RN |
13798-16-8 |
| C_ID |
C00001606
, 
|
| InChIKey |
OZXPZOHWSFDUDY-IIANADTINA-N |
| InChICode |
InChI=1S/C24H26N2O16S/c27-15-7-13-10(6-16(15)41-24-20(30)19(29)18(28)17(42-24)8-40-43(37,38)39)5-14(23(35)36)26(13)2-1-9-3-11(21(31)32)25-12(4-9)22(33)34/h1-3,6-7,12,14,17-20,24,28-30H,4-5,8H2,(H5,27,31,32,33,34,35,36,37,38,39)/t12-,14+,17+,18-,19+,20+,24-/m1/s1 |
| SMILES |
O[C@H]1[C@H]([C@@H]([C@@H](O[C@H]1Oc1c(cc2c(c1)C[C@H](/[N+]/2=C\C=C\1/C[C@@H](NC(=C1)C(=O)O)C(=O)O)C(=O)O)O)COS(=O)(=O)[O-])O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Tyr |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Chenopodiaceae | Beta vulgaris  | Ref. |
| Plantae | Phytolaccaceae | Phytolacca americana | Ref. |
| Plantae | Phytolaccaceae | Phytolacca decandra | Ref. |
|
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