| Name |
Ivangulin
[3aR-[3aalpha,5(S*),7aalpha]]-2,3,3a,4,7,7a-Hexahydro-gamma,6-dimethyl-3-methylene-2-oxo-5-benzofuranbutanoic acid methyl ester |
| Formula |
C16H22O4 |
| Mw |
278.15180919 |
| CAS RN |
14271-37-5 |
| C_ID |
C00013198
, 
|
| InChIKey |
RCKXDYPRQOIBKT-ZQWJIHNYNA-N |
| InChICode |
InChI=1S/C16H22O4/c1-9(5-6-15(17)19-4)12-8-13-11(3)16(18)20-14(13)7-10(12)2/h9,13-14H,3,5-8H2,1-2,4H3/t9-,13+,14+/m0/s1 |
| SMILES |
C=C1C(=O)O[C@@H]2CC(C)=C([C@@H](C)CCC(=O)OC)C[C@H]12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Iva angustifolia | Ref. |
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