| Name |
Rebaudioside S |
| Formula |
C44H70O22 |
| Mw |
950.43587392 |
| CAS RN |
1931085-11-8 |
| C_ID |
C00064095
|
| InChIKey |
NRSXCPNXINOJRJ-WCFHDFSKSA-N |
| InChICode |
InChI=1S/C44H70O22/c1-17-12-43-10-6-22-41(3,8-5-9-42(22,4)40(58)65-38-34(30(54)26(50)20(14-46)61-38)63-36-32(56)28(52)24(48)18(2)59-36)23(43)7-11-44(17,16-43)66-39-35(31(55)27(51)21(15-47)62-39)64-37-33(57)29(53)25(49)19(13-45)60-37/h18-39,45-57H,1,5-16H2,2-4H3/t18-,19+,20+,21+,22-,23-,24-,25+,26+,27+,28+,29-,30-,31-,32+,33+,34+,35+,36-,37+,38-,39-,41+,42+,43+,44-/m0/s1 |
| SMILES |
C=C1CC23CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5OC5OC(C)C(O)C(O)C5O)CCCC4(C)C2CCC1(OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O)C3 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Stevia rebaudiana  | Ref. |
|
|
zoom in
| Organism | Stevia rebaudiana |
|---|
| Reference | Singh, B and Sharma, R. V., Secondary Metabolites of Medicinal Plants, Vol. 3, (2020), Wiley-VCH Verlag GmbH and Co. KGaA. |
|---|
|
