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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H11NO
Molecular Weight 245.2753
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-FORMYL-1-AMINOPYRENE

SMILES

O=CNC1=C2C=CC3=CC=CC4=CC=C(C=C1)C2=C34

InChI

InChIKey=YRRFNWAQLGOASH-UHFFFAOYSA-N
InChI=1S/C17H11NO/c19-10-18-15-9-7-13-5-4-11-2-1-3-12-6-8-14(15)17(13)16(11)12/h1-10H,(H,18,19)

HIDE SMILES / InChI

Molecular Formula C17H11NO
Molecular Weight 245.2753
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 Fri Dec 15 17:59:21 UTC 2023
Edited
by admin
on Fri Dec 15 17:59:21 UTC 2023
Record UNII
0QG4IU067Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-FORMYL-1-AMINOPYRENE
Systematic Name English
N-1-PYRENYLFORMAMIDE
Systematic Name English
FORMAMIDE, N-1-PYRENYL-
Systematic Name English
Code System Code Type Description
MESH
C049354
Created by admin on Fri Dec 15 17:59:21 UTC 2023 , Edited by admin on Fri Dec 15 17:59:21 UTC 2023
PRIMARY
FDA UNII
0QG4IU067Z
Created by admin on Fri Dec 15 17:59:21 UTC 2023 , Edited by admin on Fri Dec 15 17:59:21 UTC 2023
PRIMARY
PUBCHEM
124862
Created by admin on Fri Dec 15 17:59:21 UTC 2023 , Edited by admin on Fri Dec 15 17:59:21 UTC 2023
PRIMARY
EPA CompTox
DTXSID30146142
Created by admin on Fri Dec 15 17:59:21 UTC 2023 , Edited by admin on Fri Dec 15 17:59:21 UTC 2023
PRIMARY
CAS
103915-43-1
Created by admin on Fri Dec 15 17:59:21 UTC 2023 , Edited by admin on Fri Dec 15 17:59:21 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE