Name |
Achyranthoside E Spinacoside C (+)-Spinacoside C |
Formula |
C46H70O19 |
Mw |
926.45113006 |
CAS RN |
182322-57-2 |
C_ID |
C00029638
,
|
InChIKey |
DVEJWYUSLPQXTD-RCAVWFGFNA-N |
InChICode |
InChI=1S/C46H70O19/c1-41(2)14-16-46(40(59)65-37-30(52)29(51)28(50)23(19-47)61-37)17-15-44(6)21(22(46)18-41)8-9-25-43(5)12-11-26(42(3,4)24(43)10-13-45(25,44)7)62-38-32(54)33(31(53)34(64-38)35(55)56)63-39(36(57)58)60-20-27(48)49/h8,22-26,28-34,37-39,47,50-54H,9-20H2,1-7H3,(H,48,49)(H,55,56)(H,57,58)/t22-,23+,24-,25+,26-,28+,29-,30+,31-,32+,33-,34-,37-,38+,39-,43-,44+,45+,46-/m0/s1 |
SMILES |
C1[C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@](CC2)(CCC(C1)(C)C)C(=O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)C)C)C)(C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O[C@H](OCC(=O)O)C(=O)O)O)C(=O)O |
Start Substs in Alk. Biosynthesis (Prediction) |
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Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Amaranthaceae | Achyranthes fauriei | Ref. |
Plantae | Basellaceae | Basella rubra L. | Ref. |
Plantae | Chenopodiaceae | Spinacia oleracea | Ref. |
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