Arcyriaflavin A; 2,10-Dihydroxy
AlkaPlorer ID: AK044296
Synonym: Arcyriaflavin C
IUPAC Name: 6,20-dihydroxy-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4(9),5,7,10,15,17(22),18,20-nonaene-12,14-dione
Structure
SMILES: O=C1N=C(O)C2=C3C4=CC=C(O)C=C4NC3=C3NC4=CC(O)=CC=C4C3=C12
InChI: InChI=1S/C20H11N3O4/c24-7-1-3-9-11(5-7)21-17-13(9)15-16(20(27)23-19(15)26)14-10-4-2-8(25)6-12(10)22-18(14)17/h1-6,21-22,24-25H,(H,23,26,27)
InChIKey: COUUDSNRXUXNDW-UHFFFAOYSA-N
Reference
PubChem CID: 5482346
CAS: 73697-65-1
LOTUS: LTS0030183
NPASS: NPC132329
COCONUT: CNP0294386
Source
Properties Information
Molecule Weight: 357.3250000000001
TPSA?: 121.7
MolLogP?: 3.8252000000000006
Number of H-Donors: 5
Number of H-Acceptors: 3
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | HeLa | Concentration | 10.0 | ng ml-1 | 10.1016/s0960-894x(03)00592-4 |
| Homo sapiens | HeLa | Concentration | 100.0 | ng ml-1 | 10.1016/s0960-894x(03)00592-4 |
| Homo sapiens | Zinc finger protein GLI1 | IC50 | 1800.0 | nM | 10.1021/jm801420y |
| Homo sapiens | Zinc finger protein GLI2 | IC50 | 2700.0 | nM | 10.1021/jm801420y |
| None | Unchecked | Activity | nan | None | 10.1016/j.bmcl.2007.05.033 |
