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Details

Stereochemistry RACEMIC
Molecular Formula C18H19N3O5S
Molecular Weight 389.426
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ONDANSETRON 8-SULFATE

SMILES

CN1C2=C(C3=CC=CC(OS(O)(=O)=O)=C13)C(=O)C(CN4C=CN=C4C)CC2

InChI

InChIKey=FKMUSAHZDJNPJY-UHFFFAOYSA-N
InChI=1S/C18H19N3O5S/c1-11-19-8-9-21(11)10-12-6-7-14-16(18(12)22)13-4-3-5-15(17(13)20(14)2)26-27(23,24)25/h3-5,8-9,12H,6-7,10H2,1-2H3,(H,23,24,25)

HIDE SMILES / InChI

Molecular Formula C18H19N3O5S
Molecular Weight 389.426
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Ondansetron 8-sulfate is a metabolite of the ondansetron, a drug which is used to prevent nausea and vomiting caused by cancer chemotherapy, radiation therapy, or surgery. Ondansetron is extensively metabolized in humans; the primary metabolic pathway is hydroxylation on the indole ring followed by glucuronide or sulfate conjugation.

Approval Year

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
Ondansetron metabolism and pharmacokinetics.
1992 Aug

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Sat Dec 16 10:50:48 UTC 2023
Edited
by admin
on Sat Dec 16 10:50:48 UTC 2023
Record UNII
59D7QNM478
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ONDANSETRON 8-SULFATE
Common Name English
4H-CARBAZOL-4-ONE, 1,2,3,9-TETRAHYDRO-9-METHYL-3-((2-METHYL-1H-IMIDAZOL-1-YL)METHYL)-8-(SULFOOXY)-
Systematic Name English
Code System Code Type Description
FDA UNII
59D7QNM478
Created by admin on Sat Dec 16 10:50:48 UTC 2023 , Edited by admin on Sat Dec 16 10:50:48 UTC 2023
PRIMARY
PUBCHEM
15700432
Created by admin on Sat Dec 16 10:50:48 UTC 2023 , Edited by admin on Sat Dec 16 10:50:48 UTC 2023
PRIMARY
CAS
126671-73-6
Created by admin on Sat Dec 16 10:50:48 UTC 2023 , Edited by admin on Sat Dec 16 10:50:48 UTC 2023
PRIMARY
Related Record Type Details
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