Molecule

Palustrine

AlkaPlorer ID: AK309244

Synonym: 1,4,5,6,7,8,9,10,11,13,14,16a-Dodecahydro-13-(1-hydroxypropyl)pyrido[2,1-d][1,5,9]triazacyclotridecin-2(3H)-one, Equisetin

IUPAC Name: 17-(1-hydroxypropyl)-1,5,10-triazabicyclo[11.4.0]heptadec-14-en-11-one

SMILES: CCC(O)C1CC=CC2CC(O)=NCCCCNCCCN21

InChI: InChI=1S/C17H31N3O2/c1-2-16(21)15-8-5-7-14-13-17(22)19-11-4-3-9-18-10-6-12-20(14)15/h5,7,14-16,18,21H,2-4,6,8-13H2,1H3,(H,19,22)

InChIKey: YBZUGUWOQLUNKD-UHFFFAOYSA-N

PubChem CID: 4485538

CAS: 22324-44-3

NPASS: NPC218553

COCONUT: CNP0221416.2

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	Equisetum	Equisetaceae	Equisetales	Polypodiopsida	Streptophyta	Viridiplantae	Eukaryota
Equisetum hyemale	Equisetum	Equisetaceae	Equisetales	Polypodiopsida	Streptophyta	Viridiplantae	Eukaryota
Equisetum arvense	Equisetum	Equisetaceae	Equisetales	Polypodiopsida	Streptophyta	Viridiplantae	Eukaryota
Equisetum ramosissimum	Equisetum	Equisetaceae	Equisetales	Polypodiopsida	Streptophyta	Viridiplantae	Eukaryota
Equisetum palustre	Equisetum	Equisetaceae	Equisetales	Polypodiopsida	Streptophyta	Viridiplantae	Eukaryota
None	Equisetum	Equisetaceae	Equisetales	Polypodiopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 309.45400000000006

TPSA？: 68.08999999999999

MolLogP？: 1.8765

Number of H-Donors: 3

Number of H-Acceptors: 4

RingCount: 2

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi