Ambelline; Ac
AlkaPlorer ID: AK284117
Synonym: 11-O-Acetylambelline
IUPAC Name: (9,15-dimethoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,16-tetraen-18-yl) acetate
Structure
SMILES: COC1=C2CN3CC(OC(C)=O)C4(C=CC(OC)CC34)C2=CC2=C1OCO2
InChI: InChI=1S/C20H23NO6/c1-11(22)27-17-9-21-8-13-14(7-15-19(18(13)24-3)26-10-25-15)20(17)5-4-12(23-2)6-16(20)21/h4-5,7,12,16-17H,6,8-10H2,1-3H3
InChIKey: DZXAUWNEDZVVNU-UHFFFAOYSA-N
Reference
Alkaloids from Ammocharis tinneana
PubChem CID: 78180690
CAS: 98983-14-3
LOTUS: LTS0257668
COCONUT: CNP0269465.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Brunsvigia | Amaryllidaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Brunsvigia | Amaryllidaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 373.4050000000002
TPSA？: 66.46000000000001
MolLogP？: 1.7660999999999996
Number of H-Donors: 0
Number of H-Acceptors: 7
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|