Spermidine phosphate salt

CAT: 0024-sc-296412Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-296412Size:1 g

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CAS Number

49721-50-8

Chemical Information

1,4-Butanediamine, N-(3-aminopropyl)-, phosphate (2:3)

CAS Number	49721-50-8
PubChem CID	39519
IUPAC Name	bis(4-azaniumylbutyl(3-azaniumylpropyl)azanium);hydrogen phosphate
Molecular Formula	C14H47N6O12P3
Molecular Weight	584.48
Topological Polar Surface Area	394
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	14
Heavy Atom Count	35
Formal Charge	0
Complexity	103

SMILES

C(CC[NH2+]CCC[NH3+])C[NH3+].C(CC[NH2+]CCC[NH3+])C[NH3+].OP(=O)([O-])[O-].OP(=O)([O-])[O-].OP(=O)([O-])[O-]

InChI

InChI=1S/2C7H19N3.3H3O4P/c2*8-4-1-2-6-10-7-3-5-9;3*1-5(2,3)4/h2*10H,1-9H2;3*(H3,1,2,3,4)

InChIKey

RQFVSMCFDFGRDX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 49721-50-8

CID: 39519

Formula: C14H47N6O12P3

MW: 584.48

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	584.48
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	14
Exact Mass	584.24648195
Monoisotopic Mass	584.24648195
Topological Polar Surface Area	394 Å²
Heavy Atom Count	35
Formal Charge	0
Complexity	103
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	5
Compound Is Canonicalized	Yes

Catalog	Name
sc-296411A	Spermidine Phosphate
sc-296411	Spermidine Phosphate
sc-471943	Spermidine phosphate hexahydrate
sc-250826	Quinaldine phosphate salt
sc-362810	Tilmicosin phosphate salt
sc-252757	Disopyramide phosphate salt
sc-239251	Antazoline phosphate salt
sc-229665A	Urea phosphate salt
sc-229665	Urea phosphate salt
sc-214896	Dihydroxyacetone phosphate dilithium salt

Catalog	Name
466418-01	Spermidine Phosphate Salt Hexahydrate
OR1076747-01	Spermidine Phosphate
289528-01	Spermidine phosphate hexahydrate
OR1079739-01	Spermidine Phosphate [for Protein Research]
291847-01	Urea phosphate salt
GW4048-25mg	Ruxolitinib . phosphate salt
GA7223-100mg	Tilmicosin phosphate salt
OR1012222-01	Adenine Phosphate Salt
BIFK0028-01	Ruxolitinib Phosphate Salt
GTR19228454-01	Creatinine Phosphate Disodium Salt