Hydrachine A
AlkaPlorer ID: AK067465
Synonym: '(-)-Hydrachine A'
IUPAC Name: 3-[(3R,9S,9aR)-9-hydroxy-2-oxo-1,3,4,6,7,8,9,9a-octahydroquinolizin-3-yl]quinazolin-4-one
Structure
SMILES: O=C1C[C@@H]2[C@@H](O)CCCN2C[C@H]1N1C=NC2=CC=CC=C2C1=O
InChI: InChI=1S/C17H19N3O3/c21-15-6-3-7-19-9-14(16(22)8-13(15)19)20-10-18-12-5-2-1-4-11(12)17(20)23/h1-2,4-5,10,13-15,21H,3,6-9H2/t13-,14-,15+/m1/s1
InChIKey: NWZWZNPJFOBDSB-KFWWJZLASA-N
Reference
Hydrachine A, a Novel Alkaloid from the Roots of <i>Hydrangea </i><i>c</i><i>hinensis</i>
PubChem CID: 21589719
LOTUS: LTS0030976
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hydrangea chinensis | Hydrangea | Hydrangeaceae | Cornales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 313.3570000000001
TPSA？: 75.43
MolLogP？: 0.7356999999999994
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|