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Details

Stereochemistry EPIMERIC
Molecular Formula C24H27N3O8
Molecular Weight 485.4865
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ONDANSETRON 8-D-GLUCURONIDE

SMILES

CN1C2=C(C3=CC=CC(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)=C13)C(=O)C(CN5C=CN=C5C)CC2

InChI

InChIKey=BLTLDLYCSAWXFJ-DMBZKHIPSA-N
InChI=1S/C24H27N3O8/c1-11-25-8-9-27(11)10-12-6-7-14-16(18(12)28)13-4-3-5-15(17(13)26(14)2)34-24-21(31)19(29)20(30)22(35-24)23(32)33/h3-5,8-9,12,19-22,24,29-31H,6-7,10H2,1-2H3,(H,32,33)/t12?,19-,20-,21+,22-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H27N3O8
Molecular Weight 485.4865
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 5 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:02:32 GMT 2023
Edited
by admin
on Sat Dec 16 11:02:32 GMT 2023
Record UNII
33NAL20TBU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ONDANSETRON 8-D-GLUCURONIDE
Common Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 2,3,4,9-TETRAHYDRO-9-METHYL-3-((2-METHYL-1H-IMIDAZOL-1-YL)METHYL)-4-OXO-1H-CARBAZOL-8-YL
Systematic Name English
Code System Code Type Description
CAS
126671-72-5
Created by admin on Sat Dec 16 11:02:32 GMT 2023 , Edited by admin on Sat Dec 16 11:02:32 GMT 2023
PRIMARY
PUBCHEM
91668158
Created by admin on Sat Dec 16 11:02:32 GMT 2023 , Edited by admin on Sat Dec 16 11:02:32 GMT 2023
PRIMARY
FDA UNII
33NAL20TBU
Created by admin on Sat Dec 16 11:02:32 GMT 2023 , Edited by admin on Sat Dec 16 11:02:32 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE