Acetylepibaptifoline
AlkaPlorer ID: AK046981
Synonym: '', 'O-Acetylbaptifolin', 'O-Acetylepibaptifoline'
IUPAC Name: [(1S,2R,4R,9S)-14-oxo-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadeca-10,12-dien-4-yl] acetate
Structure
SMILES: CC(=O)O[C@@H]1CCN2C[C@@H]3C[C@@H](CN4C3=CC=CC4=O)[C@H]2C1
InChI: InChI=1S/C17H22N2O3/c1-11(20)22-14-5-6-18-9-12-7-13(16(18)8-14)10-19-15(12)3-2-4-17(19)21/h2-4,12-14,16H,5-10H2,1H3/t12-,13-,14+,16+/m0/s1
InChIKey: WOXXKFZZPFAEHI-TTZDDIAXSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Thermopsis chinensis | Thermopsis | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 302.3740000000001
TPSA？: 51.54
MolLogP？: 1.3615
Number of H-Donors: 0
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|