| Name |
Mesembryanthin |
| Formula |
C44H50O25 |
| Mw |
978.26411715 |
| CAS RN |
253351-27-8 |
| C_ID |
C00039749
, 
|
| InChIKey |
ISCKCKJULNOYCD-HLARACJNNA-N |
| InChICode |
InChI=1S/C44H50O25/c1-59-22-10-16(4-7-18(22)47)5-9-27(51)66-41-38(67-42-35(58)33(56)29(52)25(13-45)64-42)21(50)15-62-43(41)69-40-34(57)30(53)26(14-46)65-44(40)68-39-32(55)28-24(12-20(49)37(61-3)31(28)54)63-36(39)17-6-8-19(48)23(11-17)60-2/h4-12,21,25-26,29-30,33-35,38,40-50,52-54,56-58H,13-15H2,1-3H3/b9-5-/t21-,25-,26-,29-,30-,33+,34+,35-,38+,40-,41-,42+,43+,44+/m1/s1 |
| SMILES |
c1(c(c(c2c(c1)oc(c(c2=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@@H]1OC[C@H]([C@@H]([C@H]1OC(=O)/C=C\c1cc(c(cc1)O)OC)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O)c1ccc(c(c1)OC)O)O)OC)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Aizoaceae | Mesembryanthemum crystallinum L.  | Ref. |
|
|
zoom in
| Organism | Mesembryanthemum crystallinum L. |
|---|
| Reference | Vogt,Phytochem.,52,(1999),583 |
|---|
|
