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Details

Stereochemistry ACHIRAL
Molecular Formula C5H16O16P4
Molecular Weight 456.066
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Pentaerythritol octahydrogen tetraphosphate

SMILES

OP(O)(=O)OCC(COP(O)(O)=O)(COP(O)(O)=O)COP(O)(O)=O

InChI

InChIKey=NXWHTQVVOSZLDP-UHFFFAOYSA-N
InChI=1S/C5H16O16P4/c6-22(7,8)18-1-5(2-19-23(9,10)11,3-20-24(12,13)14)4-21-25(15,16)17/h1-4H2,(H2,6,7,8)(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
Pentaerythritol octahydrogen tetraphosphate
Systematic Name English
1,3-Propanediol, 2,2-bis[(phosphonooxy)methyl]-, 1,3-bis(dihydrogen phosphate)
Systematic Name English
1,3-Propanediol, 2,2-bis[(phosphonooxy)methyl]-, bis(dihydrogen phosphate)
Systematic Name English
Pentaerythritol, tetrakis(dihydrogen phosphate)
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID0064701
Created by admin on Sat Dec 16 12:13:41 GMT 2023 , Edited by admin on Sat Dec 16 12:13:41 GMT 2023
PRIMARY
ECHA (EC/EINECS)
231-181-6
Created by admin on Sat Dec 16 12:13:41 GMT 2023 , Edited by admin on Sat Dec 16 12:13:41 GMT 2023
PRIMARY
CAS
7440-78-0
Created by admin on Sat Dec 16 12:13:41 GMT 2023 , Edited by admin on Sat Dec 16 12:13:41 GMT 2023
PRIMARY
FDA UNII
C5QE2G43U4
Created by admin on Sat Dec 16 12:13:41 GMT 2023 , Edited by admin on Sat Dec 16 12:13:41 GMT 2023
PRIMARY
PUBCHEM
81945
Created by admin on Sat Dec 16 12:13:41 GMT 2023 , Edited by admin on Sat Dec 16 12:13:41 GMT 2023
PRIMARY
NIH
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