| Name |
3beta-Acetoxy-28,13-ursanolide. |
| Formula |
C32H50O4 |
| Mw |
498.37091008 |
| CAS RN |
28290-51-9 |
| C_ID |
C00054172
|
| InChIKey |
NJLCBLDWBHWOFU-NOAGMNDJSA-N |
| InChICode |
InChI=1S/C32H50O4/c1-19-9-15-31-18-17-30(8)29(7)14-10-22-27(4,5)24(35-21(3)33)12-13-28(22,6)23(29)11-16-32(30,36-26(31)34)25(31)20(19)2/h19-20,22-25H,9-18H2,1-8H3/t19-,20+,22+,23-,24+,25-,28+,29-,30+,31+,32+/m1/s1 |
| SMILES |
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]45OC(=O)[C@@]6(CC[C@@H](C)[C@H](C)[C@H]64)CC[C@@]5(C)[C@]3(C)CC[C@H]2C1(C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Helichrysum italicum  | Ref. |
|
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