Sodium dodecyl sulfate

Details

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Internal ID 57ab9650-17c0-4032-9e53-3b766566293d
Taxonomy Organic acids and derivatives > Organic sulfuric acids and derivatives > Sulfuric acid esters > Sulfuric acid monoesters
IUPAC Name sodium;dodecyl sulfate
SMILES (Canonical) CCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]
SMILES (Isomeric) CCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]
InChI InChI=1S/C12H26O4S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15;/h2-12H2,1H3,(H,13,14,15);/q;+1/p-1
InChI Key DBMJMQXJHONAFJ-UHFFFAOYSA-M
Popularity 73,982 references in papers

Physical and Chemical Properties

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Molecular Formula C12H25NaO4S
Molecular Weight 288.38 g/mol
Exact Mass 288.13712473 g/mol
Topological Polar Surface Area (TPSA) 74.80 Ų
XlogP 0.00

Synonyms

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151-21-3
SODIUM LAURYL SULFATE
Sodium dodecylsulfate
Sodium lauryl sulphate
Sodium dodecyl sulphate
Dodecyl sodium sulfate
Anticerumen
Gardinol
Neutrazyme
Sodium n-dodecyl sulfate
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Sodium dodecyl sulfate

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
CHEMBL1293255 P15428 15-hydroxyprostaglandin dehydrogenase [NAD+] 11220.2 nM
Potency
via CMAUP
CHEMBL2524 P06280 Alpha-galactosidase A 39810.7 nM
Potency
via CMAUP
CHEMBL1293236 P46063 ATP-dependent DNA helicase Q1 39810.7 nM
Potency
via CMAUP
CHEMBL4040 P28482 MAP kinase ERK2 39810.7 nM
Potency
via CMAUP
CHEMBL1293235 P02545 Prelamin-A/C 0.9 nM
0.9 nM
Potency
Potency
via Super-PRED
via CMAUP
CHEMBL1963 P16473 Thyroid stimulating hormone receptor 39810.7 nM
39810.7 nM
Potency
Potency
via CMAUP
via CMAUP

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 95.02% 92.08%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 92.51% 96.09%
CHEMBL2581 P07339 Cathepsin D 91.86% 98.95%
CHEMBL253 P34972 Cannabinoid CB2 receptor 90.53% 97.25%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 89.30% 97.29%
CHEMBL255 P29275 Adenosine A2b receptor 88.91% 98.59%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 87.51% 96.95%
CHEMBL2955 O95136 Sphingosine 1-phosphate receptor Edg-5 87.16% 92.86%
CHEMBL4462 Q8IXJ6 NAD-dependent deacetylase sirtuin 2 86.57% 90.24%
CHEMBL5043 Q6P179 Endoplasmic reticulum aminopeptidase 2 84.94% 91.81%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 84.83% 96.00%
CHEMBL2001 Q9H244 Purinergic receptor P2Y12 84.46% 96.00%
CHEMBL3060 Q9Y345 Glycine transporter 2 84.20% 99.17%
CHEMBL4481 P35228 Nitric oxide synthase, inducible 83.01% 94.80%
CHEMBL4588 P22894 Matrix metalloproteinase 8 82.59% 94.66%
CHEMBL4685 P14902 Indoleamine 2,3-dioxygenase 82.45% 96.38%
CHEMBL1075162 Q13304 Uracil nucleotide/cysteinyl leukotriene receptor 81.23% 80.33%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 80.37% 95.56%
CHEMBL3359 P21462 Formyl peptide receptor 1 80.36% 93.56%
CHEMBL2111367 P27986 PI3-kinase p110-alpha/p85-alpha 80.13% 94.33%
CHEMBL5255 O00206 Toll-like receptor 4 80.11% 92.50%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Glycyrrhiza glabra
Glycyrrhiza inflata
Glycyrrhiza uralensis

Cross-Links

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PubChem 3423265
NPASS NPC272426
ChEMBL CHEMBL23393