| Name |
Scrophuloside B2
(-)-Scrophuloside B2 |
| Formula |
C35H46O19 |
| Mw |
770.26332929 |
| CAS RN |
240820-59-1 |
| C_ID |
C00049600
, 
|
| InChIKey |
RNIOTCRMLGGHMI-PVBPVERONA-N |
| InChICode |
InChI=1S/C35H46O19/c1-15-25(41)27(43)29(45)35(51-15)54-32-30(46)34(48-10-9-17-3-6-18(36)20(38)11-17)52-23(14-50-33-28(44)26(42)21(39)13-49-33)31(32)53-24(40)8-5-16-4-7-19(37)22(12-16)47-2/h3-8,11-12,15,21,23,25-39,41-46H,9-10,13-14H2,1-2H3/b8-5-/t15-,21-,23+,25-,26+,27+,28+,29+,30+,31+,32+,33-,34+,35-/m0/s1 |
| SMILES |
COc1cc(/C=CC(=O)O[C@H]2[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](OCCc3ccc(O)c(O)c3)O[C@@H]2CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)ccc1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Scrophulariaceae | Scrophularia nodosa L.  | Ref. |
|
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