| Name |
Shazhiside methyl ester gentiobioside |
| Formula |
C23H36O16 |
| Mw |
568.20033511 |
| CAS RN |
76679-60-2 |
| C_ID |
C00010688
, 
|
| InChIKey |
FFKQCCZXUVIIPM-JHVZDRKZNA-N |
| InChICode |
InChI=1S/C23H36O16/c1-23(33)3-8(25)11-7(19(32)34-2)5-35-20(12(11)23)39-22-18(31)16(29)14(27)10(38-22)6-36-21-17(30)15(28)13(26)9(4-24)37-21/h5,8-18,20-22,24-31,33H,3-4,6H2,1-2H3/t8-,9+,10+,11+,12-,13+,14+,15-,16+,17-,18-,20-,21+,22+,23+/m0/s1 |
| SMILES |
[C@H]12[C@H]([C@@](C[C@@H]1O)(O)C)[C@@H](OC=C2C(=O)OC)O[C@H]1O[C@@H]([C@H]([C@H]([C@@H]1O)O)O)CO[C@@H]1O[C@@H]([C@H]([C@@H]([C@@H]1O)O)O)CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rubiaceae | Canthium subcordatum | Ref. |
|
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