168434-12-6
AlkaPlorer ID: AK063683
Synonym: 'Lepadin B', '(-)-Lepadin B'
IUPAC Name: (2S,3S,4aS,5S,8aR)-2-methyl-5-[(1E,3E)-octa-1,3-dienyl]-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-3-ol
Structure
SMILES: CCCC/C=C/C=C/[C@@H]1CCC[C@H]2N[C@@H](C)[C@@H](O)C[C@@H]12
InChI: InChI=1S/C18H31NO/c1-3-4-5-6-7-8-10-15-11-9-12-17-16(15)13-18(20)14(2)19-17/h6-8,10,14-20H,3-5,9,11-13H2,1-2H3/b7-6+,10-8+/t14-,15+,16-,17+,18-/m0/s1
InChIKey: KNDQZHFTKYJGCP-UUNOTXBASA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Clavelina lepadiformis | Clavelina | Clavelinidae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 277.452
TPSA？: 32.26
MolLogP？: 3.816600000000002
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|