N(4)-aminopropylspermine

AlkaPlorer ID: AK109677

Synonym: 'N(4)-(3-aminopropyl)spermine'

IUPAC Name: N,N',N'-tris(3-aminopropyl)butane-1,4-diamine

Structure

SMILES: NCCCNCCCCN(CCCN)CCCN

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InChI: InChI=1S/C13H33N5/c14-6-3-10-17-9-1-2-11-18(12-4-7-15)13-5-8-16/h17H,1-16H2

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InChIKey: UAGCUQRCYLGHHF-UHFFFAOYSA-N

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Reference

PubChem CID: 86175000

NPASS: NPC317296

COCONUT: CNP0278164

Source

Properties Information

Molecule Weight: 259.4419999999999

TPSA: 93.33

MolLogP: -0.2953999999999969

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT014493 C[S+](CCCN)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCCNCCCCNCCCN>>NCCCNCCCCN(CCCN)CCCN 42880