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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H13N5O
Molecular Weight 243.2645
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(7-HYDROXY-1-NAPHTHYL)BIGUANIDE

SMILES

NC(=N)NC(=N)NC1=CC=CC2=CC=C(O)C=C12

InChI

InChIKey=HOGDMMZTOLIYGR-UHFFFAOYSA-N
InChI=1S/C12H13N5O/c13-11(14)17-12(15)16-10-3-1-2-7-4-5-8(18)6-9(7)10/h1-6,18H,(H6,13,14,15,16,17)

HIDE SMILES / InChI

Molecular Formula C12H13N5O
Molecular Weight 243.2645
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 Tue Apr 01 16:44:23 GMT 2025
Edited
by admin
on Tue Apr 01 16:44:23 GMT 2025
Record UNII
139524415Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(7-HYDROXY-1-NAPHTHYL)BIGUANIDE
Systematic Name English
IMIDODICARBONIMIDIC DIAMIDE, N-(7-HYDROXY-1-NAPHTHALENYL)-
Preferred Name English
Code System Code Type Description
FDA UNII
139524415Y
Created by admin on Tue Apr 01 16:44:23 GMT 2025 , Edited by admin on Tue Apr 01 16:44:23 GMT 2025
PRIMARY
PUBCHEM
11970402
Created by admin on Tue Apr 01 16:44:23 GMT 2025 , Edited by admin on Tue Apr 01 16:44:23 GMT 2025
PRIMARY
CAS
733681-20-4
Created by admin on Tue Apr 01 16:44:23 GMT 2025 , Edited by admin on Tue Apr 01 16:44:23 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT