| Name |
Scrophuloside A8
(-)-Scrophuloside A8 |
| Formula |
C35H44O19 |
| Mw |
768.24767923 |
| CAS RN |
240820-44-4 |
| C_ID |
C00049598
, 
|
| InChIKey |
FYTGEKJFCXSGKK-VQOVXIODNA-N |
| InChICode |
InChI=1S/C35H44O19/c1-14-27(51-22(41)8-6-17-5-7-20(45-4)19(40)11-17)29(48-15(2)38)30(49-16(3)39)34(47-14)52-28-18-9-10-46-32(23(18)35(13-37)31(28)54-35)53-33-26(44)25(43)24(42)21(12-36)50-33/h5-11,14,18,21,23-34,36-37,40,42-44H,12-13H2,1-4H3/b8-6+/t14-,18-,21+,23+,24-,25-,26+,27-,28-,29+,30+,31-,32-,33-,34-,35+/m0/s1 |
| SMILES |
C1=C[C@H]2[C@H]([C@@H](O1)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)[C@@]1([C@H]([C@H]2O[C@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)C)OC(=O)/C=C/c2ccc(c(c2)O)OC)OC(=O)C)OC(=O)C)O1)CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Scrophulariaceae | Scrophularia nodosa L.  | Ref. |
|
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