(3R,4S,6S,9aS)-6-[(1E,3E)-deca-1,3-dien-1-yl]-4-methyl-octahydro-1H-quinolizin-3-yl acetate
AlkaPlorer ID: AK466940
Synonym: None
IUPAC Name: (6-deca-1,3-dienyl-4-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-3-yl) acetate
Structure
SMILES: CCCCCCC=CC=CC1CCCC2CCC(OC(C)=O)C(C)N12
InChI: InChI=1S/C22H37NO2/c1-4-5-6-7-8-9-10-11-13-20-14-12-15-21-16-17-22(25-19(3)24)18(2)23(20)21/h9-11,13,18,20-22H,4-8,12,14-17H2,1-3H3
InChIKey: NISMLZNZORHXMO-UHFFFAOYSA-N
Reference
Clavepictines A and B: cytotoxic quinolizidines from the tunicate Clavelina picta
PubChem CID: 73836240
LOTUS: LTS0146420
COCONUT: CNP0187932.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Clavelina picta | Clavelina | Clavelinidae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 347.54300000000006
TPSA？: 29.54
MolLogP？: 5.406300000000005
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|