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Details

Stereochemistry ACHIRAL
Molecular Formula C13H16N4O3
Molecular Weight 276.2916
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-DEMETHYLTRIMETHOPRIM

SMILES

COc1cc(Cc2c[nH]c(=N)[nH]c2=N)cc(c1OC)O

InChI

InChIKey=HWBPOLWLLFXEJY-UHFFFAOYSA-N
InChI=1S/C13H16N4O3/c1-19-10-5-7(4-9(18)11(10)20-2)3-8-6-16-13(15)17-12(8)14/h4-6,18H,3H2,1-2H3,(H4,14,15,16,17)

HIDE SMILES / InChI

Molecular Formula C13H16N4O3
Molecular Weight 276.2916
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 11:32:22 UTC 2021
Edited
by admin
on Sat Jun 26 11:32:22 UTC 2021
Record UNII
RY09Z6E3O8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-DEMETHYLTRIMETHOPRIM
Common Name English
3-DEMETHYL-TRIMETHOPRIM
Common Name English
2,4-DIAMINO-5-(3-HYDROXY-4,5-DIMETHOXYBENZYL)PYRIMIDINE
Systematic Name English
3'-HYDROXYTRIMETHOPRIM
Common Name English
5-((2,4-DIAMINO-5-PYRIMIDINYL)METHYL)-2,3-DIMETHOXYPHENOL
Systematic Name English
PHENOL, 5-((2,4-DIAMINO-5-PYRIMIDINYL)METHYL)-2,3-DIMETHOXY-
Systematic Name English
Code System Code Type Description
PUBCHEM
12849769
Created by admin on Sat Jun 26 11:32:23 UTC 2021 , Edited by admin on Sat Jun 26 11:32:23 UTC 2021
PRIMARY
CAS
27653-69-6
Created by admin on Sat Jun 26 11:32:23 UTC 2021 , Edited by admin on Sat Jun 26 11:32:23 UTC 2021
PRIMARY
FDA UNII
RY09Z6E3O8
Created by admin on Sat Jun 26 11:32:23 UTC 2021 , Edited by admin on Sat Jun 26 11:32:23 UTC 2021
PRIMARY
Related Record Type Details
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