Name |
Bellidioside A |
Formula |
C58H92O26 |
Mw |
1204.58768311 |
CAS RN |
156957-18-5 |
C_ID |
C00029803
,
|
InChIKey |
FPUHPXSPVPXVGB-UHFFFAOYNA-N |
InChICode |
InChI=1S/C58H92O26/c1-24-35(64)39(68)42(71)48(77-24)82-46-45(81-49-43(72)40(69)36(65)30(20-59)78-49)38(67)32(22-75-25(2)61)80-51(46)84-52(74)58-16-14-53(4,5)18-28(58)27-10-11-34-54(6)19-29(63)47(83-50-44(73)41(70)37(66)31(21-60)79-50)55(7,23-76-26(3)62)33(54)12-13-57(34,9)56(27,8)15-17-58/h10,24,28-51,59-60,63-73H,11-23H2,1-9H3/t24-,28+,29-,30-,31+,32+,33-,34+,35+,36+,37+,38+,39-,40+,41+,42-,43-,44+,45-,46+,47+,48-,49-,50-,51-,54+,55-,56-,57-,58+/m1/s1 |
SMILES |
[C@@H]1([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]1[C@H]([C@@H]([C@H]([C@@H](O1)COC(=O)C)O)O[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O[C@H]1O[C@@H]([C@@H]([C@H]([C@H]1O)O)O)C)C)C)C)(COC(=O)C)C)O[C@H]1O[C@H]([C@@H]([C@@H]([C@@H]1O)O)O)CO)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Asteraceae | Bellis perennis | Ref. |
|
|
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Organism | Bellis perennis | Reference | Yoshikawa,Chem.Pharm.Bull.,56,(2008),559 |
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