| Name |
Rhodenthoside A |
| Formula |
C42H58O22 |
| Mw |
914.34197354 |
| CAS RN |
158848-18-1 |
| C_ID |
C00053743
|
| InChIKey |
NFTKPZDGVJFCAB-APFDVHGWSA-N |
| InChICode |
InChI=1S/C42H58O22/c1-5-21-23(25(36(52)53)17-59-39(21)63-41-34(50)32(48)30(46)27(15-43)61-41)10-12-57-29(45)14-19(3)8-7-9-20(4)38(56)58-13-11-24-22(6-2)40(60-18-26(24)37(54)55)64-42-35(51)33(49)31(47)28(16-44)62-42/h5-6,9,14,17-18,21-24,27-28,30-35,39-44,46-51H,1-2,7-8,10-13,15-16H2,3-4H3,(H,52,53)(H,54,55)/b19-14+,20-9+ |
| SMILES |
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)O)C1CCOC(=O)/C=C(C)CC/C=C(C)C(=O)OCCC1C(C(=O)O)=COC(OC2OC(CO)C(O)C(O)C2O)C1C=C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Gentianaceae | Gentiana rhodantha | Ref. |
|
|
zoom in
| Organism | Gentiana rhodantha |
|---|
| Reference | Pan, Y. et al., BMC Biochemistry, 16, (2015), 9. |
|---|
|
