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Details

Stereochemistry RACEMIC
Molecular Formula C17H25N3O3S
Molecular Weight 351.464
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(((3-(2-(DIMETHYLAMINO)ETHYL)-1H-INDOL-5-YL)METHYL)SULFONYL)-2-PYRROLIDINOL

SMILES

CN(C)CCC1=CNC2=CC=C(CS(=O)(=O)N3CCCC3O)C=C12

InChI

InChIKey=UYQQYVHESFAATL-UHFFFAOYSA-N
InChI=1S/C17H25N3O3S/c1-19(2)9-7-14-11-18-16-6-5-13(10-15(14)16)12-24(22,23)20-8-3-4-17(20)21/h5-6,10-11,17-18,21H,3-4,7-9,12H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C17H25N3O3S
Molecular Weight 351.464
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 20:42:23 UTC 2023
Edited
by admin
on Thu Jul 06 20:42:23 UTC 2023
Record UNII
N6TR3763RN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(((3-(2-(DIMETHYLAMINO)ETHYL)-1H-INDOL-5-YL)METHYL)SULFONYL)-2-PYRROLIDINOL
Systematic Name English
ALMOTRIPTAN METABOLITE, 2-OH-ALMOTRIPTAN
Common Name English
2-OH-ALMOTRIPTAN
Common Name English
2-PYRROLIDINOL, 1-(((3-(2-(DIMETHYLAMINO)ETHYL)-1H-INDOL-5-YL)METHYL)SULFONYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
154700009
Created by admin on Thu Jul 06 20:42:23 UTC 2023 , Edited by admin on Thu Jul 06 20:42:23 UTC 2023
PRIMARY
CAS
603137-42-4
Created by admin on Thu Jul 06 20:42:23 UTC 2023 , Edited by admin on Thu Jul 06 20:42:23 UTC 2023
PRIMARY
FDA UNII
N6TR3763RN
Created by admin on Thu Jul 06 20:42:23 UTC 2023 , Edited by admin on Thu Jul 06 20:42:23 UTC 2023
PRIMARY
DRUG BANK
DBMET01581
Created by admin on Thu Jul 06 20:42:23 UTC 2023 , Edited by admin on Thu Jul 06 20:42:23 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE