| Name |
Rebaudioside IX |
| Formula |
C74H120O48 |
| Mw |
1776.6949057 |
| CAS RN |
1937316-64-7 |
| C_ID |
C00064098
|
| InChIKey |
UIBTUADSYHALSJ-HQXULNAGSA-N |
| InChICode |
InChI=1S/C74H120O48/c1-22-11-73-9-5-32-71(2,7-4-8-72(32,3)70(104)121-68-59(119-65-53(102)47(96)38(87)27(16-79)110-65)56(41(90)29(18-81)112-68)116-62-50(99)44(93)35(84)24(13-76)107-62)33(73)6-10-74(22,21-73)122-69-60(57(42(91)30(19-82)113-69)117-63-51(100)45(94)36(85)25(14-77)108-63)120-66-54(103)48(97)39(88)31(114-66)20-105-67-58(118-64-52(101)46(95)37(86)26(15-78)109-64)55(40(89)28(17-80)111-67)115-61-49(98)43(92)34(83)23(12-75)106-61/h23-69,75-103H,1,4-21H2,2-3H3/t23-,24-,25-,26-,27-,28-,29-,30-,31-,32+,33+,34-,35-,36-,37-,38-,39-,40-,41-,42-,43+,44+,45+,46+,47+,48+,49-,50-,51-,52-,53-,54-,55+,56+,57+,58-,59-,60-,61+,62+,63+,64+,65+,66+,67-,68+,69+,71-,72-,73-,74+/m1/s1 |
| SMILES |
C=C1CC23CCC4C(C)(C(=O)OC5OC(CO)C(O)C(OC6OC(CO)C(O)C(O)C6O)C5OC5OC(CO)C(O)C(O)C5O)CCCC4(C)C2CCC1(OC1OC(CO)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1OC1OC(COC2OC(CO)C(O)C(OC4OC(CO)C(O)C(O)C4O)C2OC2OC(CO)C(O)C(O)C2O)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. |
|---|
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