| Name |
Ternatin C4 |
| Formula |
C51H59O32 |
| Mw |
1183.2989448 |
| CAS RN |
215378-77-1 |
| C_ID |
C00014807
, 
|
| InChIKey |
LLDMWHWRSUPHJJ-CHKSOPSJNA-O |
| InChICode |
InChI=1S/C51H58O32/c52-13-27-35(61)39(65)43(69)48(80-27)75-20-4-1-17(2-5-20)3-6-32(58)73-15-29-37(63)41(67)45(71)50(82-29)78-25-8-18(7-24(34(25)60)77-49-44(70)40(66)36(62)28(14-53)81-49)47-26(11-21-22(55)9-19(54)10-23(21)76-47)79-51-46(72)42(68)38(64)30(83-51)16-74-33(59)12-31(56)57/h1-11,27-30,35-46,48-53,61-72H,12-16H2,(H3-,54,55,56,57,60)/p+1/b6-3+/t27-,28+,29-,30+,35-,36-,37-,38-,39+,40+,41+,42+,43-,44-,45-,46+,48-,49-,50-,51-/m1/s1 |
| SMILES |
O=C(O)CC(=O)OCC1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2cc(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)c(O)c(O[C@@H]3OC(COC(=O)/C=C/c4ccc(O[C@@H]5OC(CO)[C@@H](O)[C@H](O)C5O)cc4)[C@@H](O)[C@H](O)C3O)c2)C(O)[C@@H](O)[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Clitoria ternatea  | Ref. |
|
|
zoom in
| Organism | Clitoria ternatea |
|---|
| Reference | Terahara,J.Nat.Prod.,61,(1998),1361 |
|---|
|
