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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H10O3S2
Molecular Weight 290.357
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL ARCTATE B

SMILES

COC(=O)C(=O)C1=CC=C(S1)C2=CC=C(S2)C#CC

InChI

InChIKey=ALURPXNWYGHPFR-UHFFFAOYSA-N
InChI=1S/C14H10O3S2/c1-3-4-9-5-6-10(18-9)11-7-8-12(19-11)13(15)14(16)17-2/h5-8H,1-2H3

HIDE SMILES / InChI

Molecular Formula C14H10O3S2
Molecular Weight 290.357
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 20:18:01 GMT 2023
Edited
by admin
on Fri Dec 15 20:18:01 GMT 2023
Record UNII
36WKN1THTG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL ARCTATE B
Common Name English
(2,2'-BITHIOPHENE)-5-ACETIC ACID, .ALPHA.-OXO-5'-(1-PROPYN-1-YL)-, METHYL ESTER
Common Name English
(2,2'-BITHIOPHENE)-5-ACETIC ACID, .ALPHA.-OXO-5'-(1-PROPYNYL)-, METHYL ESTER
Common Name English
ARCTIC ACID B METHYL ESTER
Common Name English
Code System Code Type Description
CAS
102054-42-2
Created by admin on Fri Dec 15 20:18:01 GMT 2023 , Edited by admin on Fri Dec 15 20:18:01 GMT 2023
PRIMARY
FDA UNII
36WKN1THTG
Created by admin on Fri Dec 15 20:18:01 GMT 2023 , Edited by admin on Fri Dec 15 20:18:01 GMT 2023
PRIMARY
PUBCHEM
71587387
Created by admin on Fri Dec 15 20:18:01 GMT 2023 , Edited by admin on Fri Dec 15 20:18:01 GMT 2023
PRIMARY
EPA CompTox
DTXSID90144568
Created by admin on Fri Dec 15 20:18:01 GMT 2023 , Edited by admin on Fri Dec 15 20:18:01 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT