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Details

Stereochemistry ACHIRAL
Molecular Formula C12H17N3O2
Molecular Weight 235.2823
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(3-AMINO-4-OXO-5,6,7,8-TETRAHYDROQUINAZOLIN-2-YL)BUTANAL

SMILES

NN1C(=O)C2=C(CCCC2)N=C1CCCC=O

InChI

InChIKey=SKIBFHOLZOIYKU-UHFFFAOYSA-N
InChI=1S/C12H17N3O2/c13-15-11(7-3-4-8-16)14-10-6-2-1-5-9(10)12(15)17/h8H,1-7,13H2

HIDE SMILES / InChI

Molecular Formula C12H17N3O2
Molecular Weight 235.2823
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 Dec 16 15:26:28 UTC 2023
Edited
by admin
on Sat Dec 16 15:26:28 UTC 2023
Record UNII
5WSQ6KRQ4U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(3-AMINO-4-OXO-5,6,7,8-TETRAHYDROQUINAZOLIN-2-YL)BUTANAL
Systematic Name English
TZB-30878 METABOLITE M8
Common Name English
4-(3-AMINO-4-OXO-3,4,5,6,7,8-HEXAHYDROQUINAZOLIN-2-YL)BUTANAL
Systematic Name English
Code System Code Type Description
PUBCHEM
146019573
Created by admin on Sat Dec 16 15:26:28 UTC 2023 , Edited by admin on Sat Dec 16 15:26:28 UTC 2023
PRIMARY
FDA UNII
5WSQ6KRQ4U
Created by admin on Sat Dec 16 15:26:28 UTC 2023 , Edited by admin on Sat Dec 16 15:26:28 UTC 2023
PRIMARY
Related Record Type Details
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