| Name |
Boerhavilanostenyl benzoate |
| Formula |
C43H64O8 |
| Mw |
708.46011902 |
| CAS RN |
219686-54-1 |
| C_ID |
C00019362
, 
|
| InChIKey |
YSZPGWVKMANYKI-ZKNCTORLNA-N |
| InChICode |
InChI=1S/C43H64O8/c1-26(25-49-39-36(47)35(46)37(32(24-44)50-39)51-38(48)28-14-9-8-10-15-28)12-11-13-27(2)29-18-22-43(7)31-16-17-33-40(3,4)34(45)20-21-41(33,5)30(31)19-23-42(29,43)6/h8-10,14-15,17,26-27,29-32,35-37,39,44,46-47H,11-13,16,18-25H2,1-7H3/t26-,27+,29+,30-,31-,32+,35-,36+,37?,39+,41+,42+,43-/m0/s1 |
| SMILES |
CC(CCC[C@@H](C)C1CC[C@@]2(C)C3CC=C4C(C)(C)C(=O)CC[C@]4(C)C3CC[C@]12C)CO[C@@H]1OC(CO)[C@@H](OC(=O)c2ccccc2)[C@H](O)C1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Nyctaginaceae | Boerhavia diffusa  | Ref. |
|
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