polidocanol (CHEBI:46859)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	polidocanol

ChEBI ID	CHEBI:46859

Definition	A hydroxypolyether that is nonaethylene glycol in which one of the terminal hydroxy functions is substituted by a lauryl (dodecyl) group.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:34927, CHEBI:41445

Supplier Information

Download	Molfile XML SDF

more structures >>

Wikipedia	License

Read full article at Wikipedia

Formula

C30H62O10

Net Charge

Average Mass

582.80728

Monoisotopic Mass

582.43430

InChI

InChI=1S/C30H62O10/c1-2-3-4-5-6-7-8-9-10-11-13-32-15-17-34-19-21-36-23-25-38-27-29-40-30-28-39-26-24-37-22-20-35-18-16-33-14-12-31/h31H,2-30H2,1H3

InChIKey

ONJQDTZCDSESIW-UHFFFAOYSA-N

SMILES

CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO

Roles Classification
Chemical Role(s):	nonionic surfactant A surfactant with an uncharged hydrophilic headgroup.

Biological Role(s):	hepatotoxic agent A role played by a chemical compound exihibiting itself through the ability to induce damage to the liver in animals. sclerotherapy agent A sclerotherapy agent is used to treat blood vessels or blood vessel malformations (vascular malformations) and also those of the lymphatic system by injection into the vessels, which makes them shrink.

ChEBI Ontology
Outgoing	polidocanol (CHEBI:46859) has functional parent nonaethylene glycol (CHEBI:39784) polidocanol (CHEBI:46859) has role hepatotoxic agent (CHEBI:50908) polidocanol (CHEBI:46859) has role nonionic surfactant (CHEBI:38828) polidocanol (CHEBI:46859) has role sclerotherapy agent (CHEBI:63923) polidocanol (CHEBI:46859) is a hydroxypolyether (CHEBI:46792)

IUPAC Name

3,6,9,12,15,18,21,24,27-nonaoxanonatriacontan-1-ol

Synonyms	Sources
DODECYL NONA ETHYLENE GLYCOL ETHER	PDBeChem
Nonaethylene glycol monododecyl ether	KEGG COMPOUND
nonaethylene glycol monolauryl ether	ChEBI
Polidocanol	KEGG COMPOUND

Last Modified

16 February 2012