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Details

Stereochemistry ACHIRAL
Molecular Formula C12H8OS2
Molecular Weight 232.321
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ARCTINAL

SMILES

CC#CC1=CC=C(S1)C2=CC=C(S2)C=O

InChI

InChIKey=ZEAXBOPUTILUGH-UHFFFAOYSA-N
InChI=1S/C12H8OS2/c1-2-3-9-4-6-11(14-9)12-7-5-10(8-13)15-12/h4-8H,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
APHYLLOCLADIN
Preferred Name English
ARCTINAL
Common Name English
(2,2'-BITHIOPHENE)-5-CARBOXALDEHYDE, 5'-(1-PROPYNYL)-
Systematic Name English
(2,2'-BITHIOPHENE)-5-CARBOXALDEHYDE, 5'-(1-PROPYN-1-YL)-
Systematic Name English
Code System Code Type Description
FDA UNII
OAV127GEXU
Created by admin on Mon Mar 31 20:22:04 GMT 2025 , Edited by admin on Mon Mar 31 20:22:04 GMT 2025
PRIMARY
CAS
102054-37-5
Created by admin on Mon Mar 31 20:22:04 GMT 2025 , Edited by admin on Mon Mar 31 20:22:04 GMT 2025
PRIMARY
EPA CompTox
DTXSID50144564
Created by admin on Mon Mar 31 20:22:04 GMT 2025 , Edited by admin on Mon Mar 31 20:22:04 GMT 2025
PRIMARY
PUBCHEM
13779265
Created by admin on Mon Mar 31 20:22:04 GMT 2025 , Edited by admin on Mon Mar 31 20:22:04 GMT 2025
PRIMARY
SUBSTANCE RECORD
Structure of ARCTINAL
NIH
NCATS
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