| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
OOSPOLACTONE
ID: ALA477547
Max Phase: Preclinical
Molecular Formula: C11H10O3
Molecular Weight: 190.20
Molecule Type: Small molecule
Associated Items:
Representations
Synonyms (1): Oospolactone
Synonyms from Alternative Forms(1):
Canonical SMILES: Cc1oc(=O)c2c(O)cccc2c1C
Standard InChI: InChI=1S/C11H10O3/c1-6-7(2)14-11(13)10-8(6)4-3-5-9(10)12/h3-5,12H,1-2H3
Standard InChI Key: BGAZGUQSJUQJTG-UHFFFAOYSA-N
Associated Targets(non-human)
Alternaria 24 Activities
Molecule Features
| Natural Product: Yes | Oral: No | Chemical Probe: No | Parenteral: No |
| Molecule Type: Small molecule | Topical: No | First In Class: No | Black Box: No |
| Chirality: No | Availability: No | Prodrug: No |
Drug Indications
| MESH ID | MESH Heading | EFO IDs | EFO Terms | Max Phase for Indication | References |
|---|
Mechanisms of Action
| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
|---|
Properties
| Molecular Weight: 190.20 | Molecular Weight (Monoisotopic): 190.0630 | AlogP: 2.12 | #Rotatable Bonds: 0 |
| Polar Surface Area: 50.44 | Molecular Species: NEUTRAL | HBA: 3 | HBD: 1 |
| #RO5 Violations: 0 | HBA (Lipinski): 3 | HBD (Lipinski): 1 | #RO5 Violations (Lipinski): 0 |
| CX Acidic pKa: 9.54 | CX Basic pKa: | CX LogP: 2.90 | CX LogD: 2.90 |
| Aromatic Rings: 2 | Heavy Atoms: 14 | QED Weighted: 0.69 | Np Likeness Score: 0.84 |
References
| 1. Zjawiony JK.. (2004) Biologically active compounds from Aphyllophorales (polypore) fungi., 67 (2): [PMID:14987072] [10.1021/np030372w] |
Source
Source(1):