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Details

Stereochemistry ACHIRAL
Molecular Formula C15H8N2O2
Molecular Weight 248.2362
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Tryptanthrine

SMILES

O=C1C2=CC=CC=C2N3C1=NC4=C(C=CC=C4)C3=O

InChI

InChIKey=VQQVWGVXDIPORV-UHFFFAOYSA-N
InChI=1S/C15H8N2O2/c18-13-10-6-2-4-8-12(10)17-14(13)16-11-7-3-1-5-9(11)15(17)19/h1-8H

HIDE SMILES / InChI

Molecular Formula C15H8N2O2
Molecular Weight 248.2362
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: P35354
Gene ID: 5743.0
Gene Symbol: PTGS2
Target Organism: Homo sapiens (Human)
Target ID: P9WGR1
Gene ID: 886523.0
Gene Symbol: inhA
Target Organism: Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
PubMed

PubMed

TitleDatePubMed
Tryptanthrin Analogues as Inhibitors of Enoyl-acyl Carrier Protein Reductase: Activity against Mycobacterium tuberculosis, Toxicity, Modeling of Enzyme Binding.
2019
Inhibitory activity of tryptanthrin on prostaglandin and leukotriene synthesis.
2002-10
Substance Class Chemical
Created
by admin
on Tue Apr 01 19:53:00 GMT 2025
Edited
by admin
on Tue Apr 01 19:53:00 GMT 2025
Record UNII
4Y6E3F2U66
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Tryptanthrine
Common Name English
NSC-349447
Preferred Name English
Tryptanthrin
Common Name English
Indolo[2,1-b]quinazoline-6,12-dione
Systematic Name English
Triptantrin
Common Name English
Code System Code Type Description
SMS_ID
300000051347
Created by admin on Tue Apr 01 19:53:00 GMT 2025 , Edited by admin on Tue Apr 01 19:53:00 GMT 2025
PRIMARY
EPA CompTox
DTXSID90157431
Created by admin on Tue Apr 01 19:53:00 GMT 2025 , Edited by admin on Tue Apr 01 19:53:00 GMT 2025
PRIMARY
PUBCHEM
73549
Created by admin on Tue Apr 01 19:53:00 GMT 2025 , Edited by admin on Tue Apr 01 19:53:00 GMT 2025
PRIMARY
NSC
349447
Created by admin on Tue Apr 01 19:53:00 GMT 2025 , Edited by admin on Tue Apr 01 19:53:00 GMT 2025
PRIMARY
FDA UNII
4Y6E3F2U66
Created by admin on Tue Apr 01 19:53:00 GMT 2025 , Edited by admin on Tue Apr 01 19:53:00 GMT 2025
PRIMARY
CAS
13220-57-0
Created by admin on Tue Apr 01 19:53:00 GMT 2025 , Edited by admin on Tue Apr 01 19:53:00 GMT 2025
PRIMARY