Molecule

1,13-Diamino-4,9-diazatridecane

AlkaPlorer ID: AK090486

Synonym: 1,5,10,15-Tetraazapentadecane, N1-(3-Aminopropyl)homospermidine

IUPAC Name: N'-[4-(3-aminopropylamino)butyl]butane-1,4-diamine

SMILES: NCCCCNCCCCNCCCN

InChI: InChI=1S/C11H28N4/c12-6-1-2-8-14-9-3-4-10-15-11-5-7-13/h14-15H,1-13H2

InChIKey: BKISDFRMYYNEKU-UHFFFAOYSA-N

PubChem CID: 10059187

CAS: 86812-44-4

SuperNatural Ⅲ: SN0027939

COCONUT: CNP0402485

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Agrobacterium sp.	Agrobacterium	Rhizobiaceae	Hyphomicrobiales	Alphaproteobacteria	Pseudomonadota	None	Bacteria
None	Thermoleophilum	Thermoleophilaceae	Thermoleophilales	Thermoleophilia	Actinomycetota	None	Bacteria
Thermoleophilum album	Thermoleophilum	Thermoleophilaceae	Thermoleophilales	Thermoleophilia	Actinomycetota	None	Bacteria
Acidothermus sp.	Acidothermus	Acidothermaceae	Acidothermales	Actinomycetes	Actinomycetota	None	Bacteria

Molecule Weight: 216.373

TPSA？: 76.1

MolLogP？: 0.0335000000000019

Number of H-Donors: 4

Number of H-Acceptors: 4

RingCount: 0

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi

AKRT ID	Reaction	Reaction Link ID
AKRT017966	NCCCCN.NCCCCNCCCN>>NCCCCNCCCCNCCCN	enzymemap_40537
AKRT017968	NCCCCN.NCCCNCCCCNCCCN>>NCCCCNCCCCNCCCN	enzymemap_40547
AKRT018007	NCCCCNCCCCNCCCN>>NCCCCNCCCCN	enzymemap_40537
AKRT018008	NCCCCNCCCCNCCCN>>NCCCN	enzymemap_40537