None
AlkaPlorer ID: AK323460
Synonym: None
IUPAC Name: (2S,3R,7R,9S,10S)-9,14-dihydroxy-4-methyl-11,16,18-trioxa-4-azapentacyclo[11.7.0.02,10.03,7.015,19]icosa-1(20),13,15(19)-trien-12-one
Structure
SMILES: CN1CC[C@@H]2C[C@H](O)[C@H]3OC(=O)C4=C(O)C5=C(C=C4[C@H]3[C@@H]21)OCO5
InChI: InChI=1S/C17H19NO6/c1-18-3-2-7-4-9(19)15-11(13(7)18)8-5-10-16(23-6-22-10)14(20)12(8)17(21)24-15/h5,7,9,11,13,15,19-20H,2-4,6H2,1H3/t7-,9+,11+,13-,15-/m1/s1
InChIKey: BLDWBTXUTAIWSY-TZBUPLKMSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hippeastrum argentinum | Hippeastrum | Amaryllidaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 333.3400000000001
TPSA？: 88.46000000000001
MolLogP？: 0.8284
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Electrophorus electricus | Acetylcholinesterase | IC50 | 114070.0 | nM | 10.1021/acs.jnatprod.5b00785 |
| Equus caballus | Cholinesterase | IC50 | 67300.0 | nM | 10.1021/acs.jnatprod.5b00785 |
| None | Unchecked | Ratio IC50 | 1.69 | None | 10.1021/acs.jnatprod.5b00785 |