Molecule

14-oxo-7,15-diazatetracyclo[7.7.1.0²,?.0¹?,¹?]heptadecan-4-yl 2-aminobenzoate

AlkaPlorer ID: AK254525

Synonym: None

IUPAC Name: [(1S,2S,4S,9S,10R)-14-oxo-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-4-yl] 2-aminobenzoate

Structure

SMILES: NC1=CC=CC=C1C(=O)O[C@H]1CCN2C[C@@H]3C[C@@H](CN4C(=O)CCC[C@H]34)[C@@H]2C1

InChI: InChI=1S/C22H29N3O3/c23-18-5-2-1-4-17(18)22(27)28-16-8-9-24-12-14-10-15(20(24)11-16)13-25-19(14)6-3-7-21(25)26/h1-2,4-5,14-16,19-20H,3,6-13,23H2/t14-,15-,16-,19+,20-/m0/s1

InChIKey: OEPJRGZBPIEMEZ-DAELLWKTSA-N

Reference

Quinolizidine alkaloids from Lupinus lanatus

PubChem CID: 163047965

LOTUS: LTS0007168

NPASS: NPC225899

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Oscillatoria amoena	Oscillatoria	Oscillatoriaceae	Oscillatoriales	Cyanophyceae	Cyanobacteriota	None	Bacteria
Lupinus lanatus	Lupinus	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Neotermes connexus	Neotermes	Kalotermitidae	Blattodea	Insecta	Arthropoda	Metazoa	Eukaryota
Strophanthus courmontii	Strophanthus	Apocynaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 383.49200000000025

TPSA？: 75.87

MolLogP？: 2.2894

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi