| Name |
Senegin II |
| Formula |
C70H104O32 |
| Mw |
1456.65107123 |
| CAS RN |
34366-31-9 |
| C_ID |
C00003551
, 
|
| InChIKey |
MNXFXXWQAAMVMW-XPBOISENNA-N |
| InChICode |
InChI=1S/C70H104O32/c1-29-54(99-58-49(82)45(78)39(27-92-58)97-60-50(83)46(79)43(76)37(25-71)95-60)48(81)52(85)59(93-29)100-56-53(86)55(98-42(75)15-11-31-10-13-35(90-8)36(22-31)91-9)30(2)94-62(56)102-64(89)69-19-18-65(3,4)23-33(69)32-12-14-40-66(5)24-34(74)57(101-61-51(84)47(80)44(77)38(26-72)96-61)68(7,63(87)88)41(66)16-17-67(40,6)70(32,28-73)21-20-69/h10-13,15,22,29-30,33-34,37-41,43-62,71-74,76-86H,14,16-21,23-28H2,1-9H3,(H,87,88)/b15-11+/t29-,30+,33-,34-,37-,38-,39+,40+,41+,43-,44-,45-,46-,47-,48-,49-,50+,51-,52+,53-,54-,55-,56-,57-,58+,59-,60-,61+,62-,66+,67+,68-,69-,70-/m0/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)C)OC(=O)/C=C/c1ccc(c(c1)OC)OC)O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O[C@@H]1[C@H]([C@H]([C@@H](CO1)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)CO)O)O)O)O)O)C)CO)C)C)(C)C(=O)O)O[C@@H]1[C@H]([C@H]([C@H]([C@@H](O1)CO)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Polygalaceae | Polygala glomerata  | Ref. |
| Plantae | Polygalaceae | Polygala senega | Ref. |
|
|
zoom in
| Organism | Polygala senega |
|---|
| Reference | Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter53 |
|---|
|
