1-(Prop-1-enyltetrasulfanyl)propane

Details

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Internal ID b229c9a0-54b9-4ec9-8369-d18ba47a9908
Taxonomy Organosulfur compounds > Sulfenyl compounds
IUPAC Name 1-(prop-1-enyltetrasulfanyl)propane
SMILES (Canonical) CCCSSSSC=CC
SMILES (Isomeric) CCCSSSSC=CC
InChI InChI=1S/C6H12S4/c1-3-5-7-9-10-8-6-4-2/h3,5H,4,6H2,1-2H3
InChI Key RKTJCWCBNXCDDQ-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C6H12S4
Molecular Weight 212.40 g/mol
Exact Mass 211.98218508 g/mol
Topological Polar Surface Area (TPSA) 101.00 Ų
XlogP 3.40

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 1-(Prop-1-enyltetrasulfanyl)propane

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
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 90.76% 96.09%
CHEMBL2581 P07339 Cathepsin D 86.45% 98.95%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 84.93% 97.21%
CHEMBL221 P23219 Cyclooxygenase-1 84.56% 90.17%
CHEMBL226 P30542 Adenosine A1 receptor 82.49% 95.93%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 80.88% 89.34%

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.
Allium ampeloprasum

Cross-Links

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PubChem 528717
LOTUS LTS0058226
wikiData Q105238844