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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H18N2O3
Molecular Weight 226.2722
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PENTOBARBITAL, (R)-

SMILES

CCC[C@@H](C)C1(CC)C(=O)NC(=O)NC1=O

InChI

InChIKey=WEXRUCMBJFQVBZ-SSDOTTSWSA-N
InChI=1S/C11H18N2O3/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)/t7-/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H18N2O3
Molecular Weight 226.2722
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:21:27 UTC 2023
Edited
by admin
on Fri Dec 15 15:21:27 UTC 2023
Record UNII
8DF73ON6SJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PENTOBARBITAL, (R)-
Common Name English
2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-ETHYL-5-((1R)-1-METHYLBUTYL)-
Systematic Name English
2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-ETHYL-5-(1-METHYLBUTYL)-, (R)-
Common Name English
BARBITURIC ACID, 5-ETHYL-5-(1-METHYLBUTYL)-, (+)-
Systematic Name English
PENTOBARBITAL, (+)-
Common Name English
PENTOBARBITONE, (+)-
Common Name English
Code System Code Type Description
CAS
21045-50-1
Created by admin on Fri Dec 15 15:21:27 UTC 2023 , Edited by admin on Fri Dec 15 15:21:27 UTC 2023
PRIMARY
FDA UNII
8DF73ON6SJ
Created by admin on Fri Dec 15 15:21:27 UTC 2023 , Edited by admin on Fri Dec 15 15:21:27 UTC 2023
PRIMARY
PUBCHEM
88983
Created by admin on Fri Dec 15 15:21:27 UTC 2023 , Edited by admin on Fri Dec 15 15:21:27 UTC 2023
PRIMARY
Related Record Type Details
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