The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
Preferred Name

pentosan polysulfate
Synonyms

C10H18O21S4

[(2S,3R,4S,5R)-5-hydroxy-2-{[(3R,4S,5R,6R)-6-hydroxy-4,5-bis(sulfooxy)oxan-3-yl]oxy}-4-(sulfooxy)oxan-3-yl]oxidanesulfonic acid

ID

http://purl.obolibrary.org/obo/dinto_DB00686

AHFScode

92:00.00

ATCCode

C05BA04

binds

http://purl.obolibrary.org/obo/dinto_1596

http://purl.obolibrary.org/obo/dinto_3506

http://purl.obolibrary.org/obo/dinto_1790

blocks

http://purl.obolibrary.org/obo/dinto_3506

http://purl.obolibrary.org/obo/dinto_1790

CASRN

37300-21-3

DBBrand

elmiron

Definition

A sulfated pentosyl polysaccharide with heparin-like properties. [PubChem]

has pharmacological target

http://purl.obolibrary.org/obo/dinto_3506

http://purl.obolibrary.org/obo/dinto_1790

InChI

InChI=1S/C10H18O21S4/c11-3-1-26-10(8(31-35(22,23)24)5(3)28-32(13,14)15)27-4-2-25-9(12)7(30-34(19,20)21)6(4)29-33(16,17)18/h3-12H,1-2H2,(H,13,14,15)(H,16,17,18)(H,19,20,21)(H,22,23,24)/t3-,4-,5+,6+,7-,8-,9-,10+/m1/s1

InChIKey

InChIKey=FCCNSUIJIOOXEZ-SJYYZXOBSA-N

inhibits

http://purl.obolibrary.org/obo/dinto_1596

label

pentosan polysulfate

modulates

http://purl.obolibrary.org/obo/dinto_3506

http://purl.obolibrary.org/obo/dinto_1790

prefixIRI

obo2:dinto_DB00686

prefLabel

pentosan polysulfate

SMILES

O[C@@H]1CO[C@@H](O[C@@H]2CO[C@@H](O)[C@H](OS(O)(=O)=O)[C@H]2OS(O)(=O)=O)[C@H](OS(O)(=O)=O)[C@H]1OS(O)(=O)=O

Synonym

C10H18O21S4

[(2S,3R,4S,5R)-5-hydroxy-2-{[(3R,4S,5R,6R)-6-hydroxy-4,5-bis(sulfooxy)oxan-3-yl]oxy}-4-(sulfooxy)oxan-3-yl]oxidanesulfonic acid

xref

Drugs Product Database (DPD):2082101

PubChem Compound:37720

PharmGKB:PA164774806

RxList:http://www.rxlist.com/cgi/generic2/pento.htm

PubChem Substance:46509187

ChemSpider:34595

subClassOf

http://purl.obolibrary.org/obo/dinto_000055

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