| Name |
Tragopogonoside E |
| Formula |
C53H84O24 |
| Mw |
1104.53525361 |
| CAS RN |
142784-44-9 |
| C_ID |
C00040524
, 
|
| InChIKey |
FLWVKSVFNCYENR-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C53H84O24/c1-48(2)14-15-53(47(69)77-43-38(66)39(23(56)20-70-43)74-44-36(64)32(60)30(58)24(18-54)71-44)22(16-48)21-8-9-27-50(5)12-11-29(49(3,4)26(50)10-13-51(27,6)52(21,7)17-28(53)57)73-46-41(35(63)34(62)40(75-46)42(67)68)76-45-37(65)33(61)31(59)25(19-55)72-45/h8,22-41,43-46,54-66H,9-20H2,1-7H3,(H,67,68)/t22-,23-,24-,25-,26-,27-,28+,29-,30-,31+,32+,33+,34-,35-,36+,37-,38-,39-,40-,41-,43+,44+,45+,46-,50+,51+,52+,53+/m1/s1 |
| SMILES |
C1[C@H](C([C@@H]2[C@](C1)([C@@H]1[C@](CC2)([C@@]2(C(=CC1)[C@@H]1[C@]([C@H](C2)O)(CCC(C1)(C)C)C(=O)O[C@H]1[C@@H]([C@@H]([C@@H](CO1)O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@@H]1O)O)O)CO)O)C)C)C)(C)C)O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C(=O)O)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Tragopogon pratensis  | Ref. |
|
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