| Name |
Itoside J
(-)-Itoside J |
| Formula |
C40H42O19 |
| Mw |
826.23202916 |
| CAS RN |
1016275-79-8 |
| C_ID |
C00039469
, 
|
| InChIKey |
VJDJBHKKFHYOAP-PEFXGDRSNA-N |
| InChICode |
InChI=1S/C40H42O19/c41-16-27-29(44)31(46)33(48)37(58-27)56-25-10-8-23(42)14-21(25)13-20-7-4-12-40(53,35(20)50)39(52)55-17-22-15-24(43)9-11-26(22)57-38-34(49)32(47)30(45)28(59-38)18-54-36(51)19-5-2-1-3-6-19/h1-6,8-15,27-34,37-38,41-49,53H,7,16-18H2/b20-13+/t27-,28-,29-,30-,31+,32+,33-,34-,37-,38-,40+/m1/s1 |
| SMILES |
O=C(OC[C@H]1O[C@@H](Oc2ccc(O)cc2COC(=O)C2(O)C=CC/C(=Cc3cc(O)ccc3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C2=O)[C@H](O)[C@@H](O)[C@@H]1O)c1ccccc1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Flacourtiaceae | Itoa orientalis | Ref. |
|
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