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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H20NO4
Molecular Weight 350.3878
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of FAGARONINE

SMILES

COC1=CC2=C(C=CC3=C2[N+](C)=CC4=CC(OC)=C(OC)C=C34)C=C1O

InChI

InChIKey=OOKZVPUCASIEBL-UHFFFAOYSA-O
InChI=1S/C21H19NO4/c1-22-11-13-8-19(25-3)20(26-4)9-15(13)14-6-5-12-7-17(23)18(24-2)10-16(12)21(14)22/h5-11H,1-4H3/p+1

HIDE SMILES / InChI

Molecular Formula C21H19NO4
Molecular Weight 349.3799
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 Mon Mar 31 22:35:22 GMT 2025
Edited
by admin
on Mon Mar 31 22:35:22 GMT 2025
Record UNII
59HNE8RJS6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FAGARONINE
Common Name English
2-HYDROXY-3,8,9-TRIMETHOXY-5-METHYLBENZO(C)PHENANTHRIDINIUM
Preferred Name English
BENZO(C)PHENANTHRIDINIUM, 2-HYDROXY-3,8,9-TRIMETHOXY-5-METHYL-
Systematic Name English
Code System Code Type Description
CAS
52259-65-1
Created by admin on Mon Mar 31 22:35:22 GMT 2025 , Edited by admin on Mon Mar 31 22:35:22 GMT 2025
PRIMARY
WIKIPEDIA
Fagaronine
Created by admin on Mon Mar 31 22:35:22 GMT 2025 , Edited by admin on Mon Mar 31 22:35:22 GMT 2025
PRIMARY
CHEBI
28954
Created by admin on Mon Mar 31 22:35:22 GMT 2025 , Edited by admin on Mon Mar 31 22:35:22 GMT 2025
PRIMARY
FDA UNII
59HNE8RJS6
Created by admin on Mon Mar 31 22:35:22 GMT 2025 , Edited by admin on Mon Mar 31 22:35:22 GMT 2025
PRIMARY
PUBCHEM
40305
Created by admin on Mon Mar 31 22:35:22 GMT 2025 , Edited by admin on Mon Mar 31 22:35:22 GMT 2025
PRIMARY
EPA CompTox
DTXSID30200298
Created by admin on Mon Mar 31 22:35:22 GMT 2025 , Edited by admin on Mon Mar 31 22:35:22 GMT 2025
PRIMARY