Glycocitrine-I
AlkaPlorer ID: AK019874
Synonym: '', 'ConMedNP.2928', 'oriciacridone E', 'Oriciacridone E'
IUPAC Name: 1,3,5-trihydroxy-10-methyl-4-(3-methylbut-2-enyl)acridin-9-one
Structure
SMILES: CC(C)=CCC1=C2C(=C(O)C=C1O)C(=O)C1=CC=CC(O)=C1N2C
InChI: InChI=1S/C19H19NO4/c1-10(2)7-8-11-14(22)9-15(23)16-18(11)20(3)17-12(19(16)24)5-4-6-13(17)21/h4-7,9,21-23H,8H2,1-3H3
InChIKey: OPPJKACRWCPJGU-UHFFFAOYSA-N
Reference
PubChem CID: 11580650
CAS: 886227-05-0
LOTUS: LTS0042590
SuperNatural Ⅲ: SN0271861
COCONUT: CNP0302536
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Swinglea glutinosa | Swinglea | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 325.3640000000001
TPSA？: 82.69
MolLogP？: 3.317200000000001
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Cathepsin L2 | IC50 | 25000.0 | nM | 10.1016/j.bmc.2010.12.056 |
| Homo sapiens | Cathepsin L2 | Ki | 10000.0 | nM | 10.1016/j.bmc.2010.12.056 |