| Name |
Methylisohaenkeanoside |
| Formula |
C27H34O13 |
| Mw |
566.19994117 |
| CAS RN |
119864-05-0 |
| C_ID |
C00010760
, 
|
| InChIKey |
ZDZLKQAIMLXIRP-LRUVPQJSNA-N |
| InChICode |
InChI=1S/C27H34O13/c1-13-21-16(10-20(34-2)38-13)17(25(33)35-3)11-37-26(21)40-27-24(32)23(31)22(30)18(39-27)12-36-19(29)9-6-14-4-7-15(28)8-5-14/h4-9,11,13,16,18,20-24,26-28,30-32H,10,12H2,1-3H3/b9-6-/t13-,16+,18+,20+,21+,22+,23-,24-,26-,27-/m0/s1 |
| SMILES |
[C@H]12[C@H]([C@@H](OC=C1C(=O)OC)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@@H]1O)O)O)COC(=O)/C=C\c1ccc(cc1)O)[C@@H](O[C@H](C2)OC)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rubiaceae | Isertia haenkeana  | Ref. |
|
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