U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C9H13N5O2
Molecular Weight 223.2318
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9-(4-Hydroxybutyl)guanine

SMILES

NC1=NC(=O)C2=C(N1)N(CCCCO)C=N2

InChI

InChIKey=DVQJDXCYEPGOCF-UHFFFAOYSA-N
InChI=1S/C9H13N5O2/c10-9-12-7-6(8(16)13-9)11-5-14(7)3-1-2-4-15/h5,15H,1-4H2,(H3,10,12,13,16)

HIDE SMILES / InChI

Molecular Formula C9H13N5O2
Molecular Weight 223.2318
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 19:54:31 GMT 2023
Edited
by admin
on Sat Dec 16 19:54:31 GMT 2023
Record UNII
S4H2XL9TKJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
9-(4-Hydroxybutyl)guanine
Systematic Name English
6H-Purin-6-one, 2-amino-1,9-dihydro-9-(4-hydroxybutyl)-
Systematic Name English
Guanine, 9-(4-hydroxybutyl)-
Systematic Name English
2-Amino-9-(4-hydroxybutyl)-1H-purin-6(9H)-one
Systematic Name English
2-Amino-1,9-dihydro-9-(4-hydroxybutyl)-6H-purin-6-one
Systematic Name English
2-Amino-9-(4-hydroxybutyl)-9H-purin-6-ol
Systematic Name English
2-amino-9-(4-hydroxybutyl)-6-oxopurine
Systematic Name English
2-Amino-9-(4-hydroxybutyl)-6,9-dihydro-1H-purin-6-one
Systematic Name English
Code System Code Type Description
PUBCHEM
135433410
Created by admin on Sat Dec 16 19:54:31 GMT 2023 , Edited by admin on Sat Dec 16 19:54:31 GMT 2023
PRIMARY
CAS
23169-37-1
Created by admin on Sat Dec 16 19:54:31 GMT 2023 , Edited by admin on Sat Dec 16 19:54:31 GMT 2023
PRIMARY
FDA UNII
S4H2XL9TKJ
Created by admin on Sat Dec 16 19:54:31 GMT 2023 , Edited by admin on Sat Dec 16 19:54:31 GMT 2023
PRIMARY