Neolitsine; (±)-form
AlkaPlorer ID: AK307578
Synonym: None
IUPAC Name: 13-methyl-5,7,19,21-tetraoxa-13-azahexacyclo[10.10.1.02,10.04,8.016,23.018,22]tricosa-1(23),2,4(8),9,16,18(22)-hexaene
Structure
SMILES: CN1CCC2=C3C(=C4OCOC4=C2)C2=CC4=C(C=C2CC31)OCO4
InChI: InChI=1S/C19H17NO4/c1-20-3-2-10-5-16-19(24-9-23-16)18-12-7-15-14(21-8-22-15)6-11(12)4-13(20)17(10)18/h5-7,13H,2-4,8-9H2,1H3
InChIKey: GKEOKAJRKHTDOS-UHFFFAOYSA-N
Reference
Cytotoxic Aporphine Alkaloids from<i>Cassytha filiformis</i>
PubChem CID: 12313196
CAS: 2466-42-4
LOTUS: LTS0041980
COCONUT: CNP0236315.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Laurus nobilis | Laurus | Lauraceae | Laurales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Neolitsea pulchella | Neolitsea | Lauraceae | Laurales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 323.34800000000007
TPSA？: 40.16
MolLogP？: 2.896100000000001
Number of H-Donors: 0
Number of H-Acceptors: 5
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|