| 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 |
C[C@H]1[C@H](C)CC[C@]23CC[C@@]4(C)[C@]5(C)CC[C@@]6([H])C(C)(C)[C@@H](OC(C)=O)CC[C@]6(C)[C@@]5([H])CC[C@]4(OC3=O)[C@@]21[H] |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Helichrysum italicum  | Ref. |
|
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