Lanceomigine
AlkaPlorer ID: AK586613
Synonym: None
IUPAC Name: methyl (1S,6E,7S,9S,10S,12S,20R)-6-ethylidene-10-hydroxy-13-methyl-11-oxa-4,13-diazahexacyclo[10.7.1.01,10.04,9.07,20.014,19]icosa-14,16,18-triene-20-carboxylate
Structure
SMILES: C/C=C1/CN2CC[C@@]34C5=CC=CC=C5N(C)[C@H]5O[C@]3(O)[C@@H]2C[C@@H]1[C@]54C(=O)OC
InChI: InChI=1S/C22H26N2O4/c1-4-13-12-24-10-9-20-14-7-5-6-8-16(14)23(2)18-21(20,19(25)27-3)15(13)11-17(24)22(20,26)28-18/h4-8,15,17-18,26H,9-12H2,1-3H3/b13-4-/t15-,17-,18-,20-,21+,22+/m0/s1
InChIKey: YWHJXIKKMXPHRE-MNJCRSHWSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 382.46000000000015
TPSA？: 62.24
MolLogP？: 1.6325999999999998
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Electrophorus electricus | Acetylcholinesterase | IC50 | 383000.0 | nM | 10.1021/np960070c |