| Name |
Durantanin III
(-)-Durantanin III |
| Formula |
C58H94O27 |
| Mw |
1222.5982478 |
| CAS RN |
213261-67-7 |
| C_ID |
C00039057
, 
|
| InChIKey |
HNIWIDMUMXYNCL-YVGLMHEENA-N |
| InChICode |
InChI=1S/C58H94O27/c1-22-33(65)36(68)39(71)48(78-22)82-44-28(63)20-76-47(42(44)74)81-43-23(2)79-49(41(73)38(43)70)83-45-34(66)27(62)19-77-51(45)85-52(75)58-14-13-53(3,4)15-25(58)24-9-10-31-54(5)16-26(61)46(84-50-40(72)37(69)35(67)29(18-59)80-50)55(6,21-60)30(54)11-12-56(31,7)57(24,8)17-32(58)64/h9,22-23,25-51,59-74H,10-21H2,1-8H3/t22-,23-,25-,26-,27-,28+,29+,30+,31+,32+,33-,34-,35+,36+,37-,38-,39+,40+,41+,42+,43-,44-,45-,46-,47-,48-,49-,50-,51-,54-,55-,56+,57+,58+/m0/s1 |
| SMILES |
C[C@@H]1O[C@@H](OC2[C@H](O)CO[C@@H](O[C@@H]3[C@@H](O)[C@@H](O)C(O[C@H]4[C@@H](OC(=O)[C@]56CCC(C)(C)C[C@H]5C5=CC[C@@H]7[C@@]8(C)C[C@H](O)[C@H](O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@@](C)(CO)[C@@H]8CC[C@@]7(C)[C@]5(C)C[C@H]6O)OC[C@H](O)[C@@H]4O)O[C@H]3C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Verbenaceae | Duranta repens | Ref. |
|
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