Name |
Tragopogonoside D |
Formula |
C47H74O19 |
Mw |
942.48243018 |
CAS RN |
142784-43-8 |
C_ID |
C00040523
,
|
InChIKey |
WUOHYUTZWMVEEG-UHFFFAOYNA-N |
InChICode |
InChI=1S/C47H74O19/c1-42(2)14-15-47(41(60)66-38-34(57)35(22(49)19-61-38)64-39-32(55)29(52)28(51)23(18-48)62-39)21(16-42)20-8-9-25-44(5)12-11-27(63-40-33(56)30(53)31(54)36(65-40)37(58)59)43(3,4)24(44)10-13-45(25,6)46(20,7)17-26(47)50/h8,21-36,38-40,48-57H,9-19H2,1-7H3,(H,58,59)/t21-,22-,23-,24-,25-,26+,27-,28-,29+,30+,31-,32-,33-,34+,35-,36+,38+,39+,40-,44-,45-,46-,47+/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]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)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 |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Asteraceae | Tragopogon pratensis | Ref. |
|
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zoom in
Organism | Tragopogon pratensis | Reference | Tan,Phytochem.,52,(1999),153 |
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