P33

3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL

Created:	2003-04-09
Last modified:	2020-05-27

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125 entries where P33 is found as a standalone ligand1 entries where P33 is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	52
Chiral Atom Count	0
Bond Count	51
Aromatic Bond Count	0

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Chemical Component Summary
Name	3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL
Synonyms	HEPTAETHYLENE GLYCOL; PEG330
Systematic Name (OpenEye OEToolkits)	2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
Formula	C₁₄ H₃₀ O₈
Molecular Weight	326.383
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O(CCOCCO)CCOCCOCCOCCOCCO
SMILES	CACTVS	3.341	OCCOCCOCCOCCOCCOCCOCCO
SMILES	OpenEye OEToolkits	1.5.0	C(COCCOCCOCCOCCOCCOCCO)O
Canonical SMILES	CACTVS	3.341	OCCOCCOCCOCCOCCOCCOCCO
Canonical SMILES	OpenEye OEToolkits	1.5.0	C(COCCOCCOCCOCCOCCOCCO)O
InChI	InChI	1.03	InChI=1S/C14H30O8/c15-1-3-17-5-7-19-9-11-21-13-14-22-12-10-20-8-6-18-4-2-16/h15-16H,1-14H2
InChIKey	InChI	1.03	XPJRQAIZZQMSCM-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB03394
Name	Heptaethylene glycol
Groups	experimental
Synonyms	3,6,9,12,15,18-hexaoxaeicosane-1,20-diol Heptaethylene glycol Heptaethylene glycol, Peg330
Categories	Pegylated agents
CAS number	5617-32-3

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Carbonyl reductase [NADPH] 1	MSSGIHVALVTGGNKGIGLAIVRDLCRLFSGDVVLTARDVTRGQAAVQQL...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682