Molecule

156336-07-1

AlkaPlorer ID: AK058063

Synonym: '81520-41-4'

IUPAC Name: (1R,5R,6R,7R,9S,11S,12S,13S,14S)-3-amino-8,10-dioxa-2,4-diazatetracyclo[7.3.1.17,11.01,6]tetradec-3-ene-5,9,12,13,14-pentol

Structure

SMILES: N=C1N[C@H](O)[C@H]2[C@H]3O[C@]4(O)O[C@H]([C@H]3O)[C@@H](O)[C@@]2(N1)[C@@H]4O

InChI: InChI=1S/C10H15N3O7/c11-8-12-6(16)1-3-2(14)4-5(15)9(1,13-8)7(17)10(18,19-3)20-4/h1-7,14-18H,(H3,11,12,13)/t1-,2+,3-,4-,5-,6-,7+,9-,10+/m1/s1

InChIKey: LSXWHXRWALCZSK-WSXHEACLSA-N

Reference

PubChem CID: 162862372

NPASS: NPC105927

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Tadehagi triquetrum	Tadehagi	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Androstachys johnsonii	Androstachys	Picrodendraceae	Malpighiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Cestrum euanthes	Cestrum	Solanaceae	Solanales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Neopicrorhiza scrophulariiflora	Neopicrorhiza	Plantaginaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Plagiorhegma dubium	Plagiorhegma	Berberidaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Streptomyces cyanogenus	Streptomyces	Streptomycetaceae	Kitasatosporales	Actinomycetes	Actinomycetota	None	Bacteria
Alternaria eichhorniae	Alternaria	Pleosporaceae	Pleosporales	Dothideomycetes	Ascomycota	Fungi	Eukaryota

Properties Information

Molecule Weight: 289.244

TPSA？: 167.52

MolLogP？: -4.672629999999995

Number of H-Donors: 8

Number of H-Acceptors: 8

RingCount: 5

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi