NatID | 1793 |
Common Name | Rutacultin |
Molecular Formula | C16H18O4 |
Chemical Class | Coumarins and derivatives > Pyranocoumarins |
Molecular Weight | 274.121 g/mol |
Other names |
Smiles | C=CC(C)(C)c1cc2cc(OC)c(OC)cc2oc1=O |
Inchi | nan |
Inchi Key | nan |
3D Structure |
clogP | 3.27 |
TPSA | 48.67 |
HBD | 0 |
HBA | 4 |
Rotatable Bonds | 4 |
Aromatic Rings | 2 |
Heavy Atoms | 20 |
Aromatic Carbocycles | 1 |
Aromatic Heterocycles | 1 |
Number of NO | 4 |
EID | Source | Semisynthetic? | Confidence level | References |
---|---|---|---|---|
10518 | Helietta apiculata | No | Unknown | Julián Fernández, Leandro Martinez Heredia, Fernando Caracciolo, Daniel Esses, Rodrigo Suarez, Gaston Siless, Concepcion Perez, María Isabel Rodríguez‐Franco, Lucía Fernández, Jorge Palermo, Martín Lavecchia. Chemistry – A European Journal (2024), None:None p.None |
Bioassay ID | NPASS ID | Target | Activity type | Activity |
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