Molecule

12,28-Oxaircinal A

AlkaPlorer ID: AK000557

Synonym: None

IUPAC Name: (1S,2R,4R,8Z,10R,12R,13R,21Z)-28-oxa-3,16-diazahexacyclo[11.11.2.11,4.112,16.02,12.03,10]octacosa-8,21,25-triene-26-carbaldehyde

Structure

SMILES: C1CCN2CC[C@H]3C(=C[C@@]4(CC/C=C\C1)[C@H]5[C@]3(C2)C[C@H]/6N5[C@H](O4)CCC/C=C6)C=O

InChI: InChI=1S/C26H36N2O2/c29-18-20-16-26-13-8-3-1-2-4-9-14-27-15-12-22(20)25(19-27)17-21-10-6-5-7-11-23(30-26)28(21)24(25)26/h1,3,6,10,16,18,21-24H,2,4-5,7-9,11-15,17,19H2/b3-1-,10-6-/t21-,22-,23+,24+,25-,26-/m0/s1

InChIKey: FVKGXMNTCXZTDF-SUJQBYETSA-N

Reference

Manzamine B and E and Ircinal A Related Alkaloids from an Indonesian <i>Acanthostrongylophora</i> Sponge and Their Activity against Infectious, Tropical Parasitic, and Alzheimer's Diseases

PubChem CID: 11844768

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain

Properties Information

Molecule Weight: 408.5860000000001

TPSA？: 32.78

MolLogP？: 4.232000000000004

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 6

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Bos taurus	Acetylcholinesterase	Activity	None	None	10.1021/np0601399
Homo sapiens	Beta-secretase 1	Activity	None	None	10.1021/np0601399