| Name |
3-O-Acetylanthothecanolide
(-)-3-O-Acetylanthothecanolide |
| Formula |
C28H34O11 |
| Mw |
546.21011193 |
| CAS RN |
861660-02-8 |
| C_ID |
C00035224
, 
|
| InChIKey |
NKDXTBIRGROVAP-SGANKPDZNA-N |
| InChICode |
InChI=1S/C28H34O11/c1-14(29)37-21-22(2,3)17-9-18(30)36-13-24(17)16-5-7-23(4)20(15-6-8-35-11-15)38-19(31)10-27(23,33)26(16)12-25(21,32)28(24,34)39-26/h6,8,11,16-17,20-21,32-34H,5,7,9-10,12-13H2,1-4H3/t16-,17+,20+,21+,23+,24-,25-,26-,27+,28-/m1/s1 |
| SMILES |
[C@@]12(C[C@]34[C@@H]([C@]5([C@H](C([C@@H]1OC(=O)C)(C)C)CC(=O)OC5)[C@]2(O3)O)CC[C@@]1([C@]4(CC(=O)O[C@H]1c1cocc1)O)C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Meliaceae | Khaya anthotheca | Ref. |
|
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