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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H10N2.C11H22O2
Molecular Weight 380.524
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMINACRINE UNDECYLATE

SMILES

c1ccc2c(c1)c(=N)c3ccccc3[nH]2.CCCCCCCCCCC(=O)O

InChI

InChIKey=IUUJXUYYPDJKHL-UHFFFAOYSA-N
InChI=1S/C13H10N2.C11H22O2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13;1-2-3-4-5-6-7-8-9-10-11(12)13/h1-8H,(H2,14,15);2-10H2,1H3,(H,12,13)

HIDE SMILES / InChI

Molecular Formula C11H22O2
Molecular Weight 186.2916
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C13H10N2
Molecular Weight 194.2324
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 10:50:48 UTC 2021
Edited
by admin
on Sat Jun 26 10:50:48 UTC 2021
Record UNII
84ZI45DX9L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMINACRINE UNDECYLATE
Common Name English
9-ACRIDINAMINE, MONOUNDECANOATE
Systematic Name English
UNDECANOIC ACID, COMPD. WITH 9-ACRIDINAMINE (1:1)
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C28394
Created by admin on Sat Jun 26 10:50:48 UTC 2021 , Edited by admin on Sat Jun 26 10:50:48 UTC 2021
Code System Code Type Description
EPA CompTox
17162-18-4
Created by admin on Sat Jun 26 10:50:48 UTC 2021 , Edited by admin on Sat Jun 26 10:50:48 UTC 2021
PRIMARY
FDA UNII
84ZI45DX9L
Created by admin on Sat Jun 26 10:50:48 UTC 2021 , Edited by admin on Sat Jun 26 10:50:48 UTC 2021
PRIMARY
NCI_THESAURUS
C96769
Created by admin on Sat Jun 26 10:50:48 UTC 2021 , Edited by admin on Sat Jun 26 10:50:48 UTC 2021
PRIMARY
CAS
17162-18-4
Created by admin on Sat Jun 26 10:50:48 UTC 2021 , Edited by admin on Sat Jun 26 10:50:48 UTC 2021
PRIMARY
PUBCHEM
76972287
Created by admin on Sat Jun 26 10:50:48 UTC 2021 , Edited by admin on Sat Jun 26 10:50:48 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE