Molecule

lupanacosmine

AlkaPlorer ID: AK023791

Synonym: None

IUPAC Name: 1-[5-[(1S,2R,8S,9R,10S)-11-methyl-10-prop-2-enyl-7,11-diazatricyclo[7.3.1.02,7]tridecan-8-yl]-3,4-dihydro-2H-pyridin-1-yl]ethanone

Structure

SMILES: C=CC[C@H]1[C@H]2C[C@@H](CN1C)[C@H]1CCCCN1[C@@H]2C1=CN(C(C)=O)CCC1

InChI: InChI=1S/C22H35N3O/c1-4-8-21-19-13-18(14-23(21)3)20-10-5-6-12-25(20)22(19)17-9-7-11-24(15-17)16(2)26/h4,15,18-22H,1,5-14H2,2-3H3/t18-,19+,20+,21-,22+/m0/s1

InChIKey: NGYQGPQSBNFVQF-AHJNKEMKSA-N

Reference

New quinolizidine and diaza-adamantane alkaloids from Acosmium dasycarpum (Vog.) Yakovlev—Fabaceae

PubChem CID: 162855340

LOTUS: LTS0046050

SuperNatural Ⅲ: SN0245245-03

NPASS: NPC100102

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Cercospora hayi	Cercospora	Mycosphaerellaceae	Mycosphaerellales	Dothideomycetes	Ascomycota	Fungi	Eukaryota
Boehmeria caudata	Boehmeria	Urticaceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Tephrosia tinctoria	Tephrosia	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Chaenomeles japonica	Chaenomeles	Rosaceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 357.54200000000014

TPSA？: 26.79

MolLogP？: 3.2619000000000025

Number of H-Donors: 0

Number of H-Acceptors: 3

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi