phenoxazin-3-one
AlkaPlorer ID: AK270455
Synonym: None
IUPAC Name: phenoxazin-3-one
Structure
SMILES: O=C1C=CC2=NC3=CC=CC=C3OC2=C1
InChI: InChI=1S/C12H7NO2/c14-8-5-6-10-12(7-8)15-11-4-2-1-3-9(11)13-10/h1-7H
InChIKey: UOMHBFAJZRZNQD-UHFFFAOYSA-N
Reference
PubChem CID: 114834
CAS: 1916-63-8
LOTUS: LTS0237449
SuperNatural Ⅲ: SN0375881
COCONUT: CNP0417036
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Calocybe gambosa | Calocybe | Lyophyllaceae | Agaricales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 197.193
TPSA？: 43.1
MolLogP？: 2.2928
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | CCRF-CEM | IC50 | 19000.0 | nM | 10.1021/jm020913z |
| Homo sapiens | CCRF-SB | IC50 | 9000.0 | nM | 10.1021/jm020913z |
| Homo sapiens | HeLa | IC50 | 13000.0 | nM | 10.1021/jm020913z |
| Homo sapiens | HEp-2 | IC50 | 14200.0 | nM | 10.1021/jm020913z |
| Homo sapiens | MT4 | IC50 | 11000.0 | nM | 10.1021/jm020913z |