| Name |
Isoorientin 3'-O-neohesperidoside |
| Formula |
C33H40O20 |
| Mw |
756.21129372 |
| CAS RN |
102148-99-2 |
| C_ID |
C00006316
, 
|
| InChIKey |
BQKINRMSXCTWJY-QEQZLOHYNA-N |
| InChICode |
InChI=1S/C33H40O20/c1-9-21(39)25(43)29(47)32(48-9)53-31-27(45)23(41)18(8-35)52-33(31)51-15-4-10(2-3-11(15)36)14-5-12(37)19-16(49-14)6-13(38)20(24(19)42)30-28(46)26(44)22(40)17(7-34)50-30/h2-6,9,17-18,21-23,25-36,38-47H,7-8H2,1H3/t9-,17+,18-,21+,22-,23-,25+,26+,27+,28+,29-,30+,31-,32+,33-/m1/s1 |
| SMILES |
CC1O[C@@H](OC2[C@H](Oc3cc(-c4cc(=O)c5c(O)c([C@@H]6OC(CO)[C@@H](O)[C@H](O)C6O)c(O)cc5o4)ccc3O)OC(CO)[C@@H](O)[C@@H]2O)C(O)[C@@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Mniaceae | Plagiomnium affine | Ref. |
|
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