| Name |
3-O-Acetylbetulinic acid
Acetylbetulinic acid
(+)-Acetylbetulinic acid |
| Formula |
C32H50O4 |
| Mw |
498.37091008 |
| CAS RN |
10376-50-8 |
| C_ID |
C00035242
, 
|
| InChIKey |
ACWNTJJUZAIOLW-XUHXCHGMNA-N |
| InChICode |
InChI=1S/C32H50O4/c1-19(2)21-11-16-32(27(34)35)18-17-30(7)22(26(21)32)9-10-24-29(6)14-13-25(36-20(3)33)28(4,5)23(29)12-15-31(24,30)8/h21-26H,1,9-18H2,2-8H3,(H,34,35)/t21-,22-,23+,24-,25+,26+,29+,30-,31-,32+/m1/s1 |
| SMILES |
C=C(C)C1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Moraceae | Ficus microcarpa  | Ref. |
| Plantae | Solanaceae | Solanum nigrum | Ref. |
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