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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H14O3
Molecular Weight 242.2699
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Dunnione, (S)-

SMILES

C[C@@H]1OC2=C(C(=O)C(=O)C3=C2C=CC=C3)C1(C)C

InChI

InChIKey=WGENOABUKBFVAA-QMMMGPOBSA-N
InChI=1S/C15H14O3/c1-8-15(2,3)11-13(17)12(16)9-6-4-5-7-10(9)14(11)18-8/h4-8H,1-3H3/t8-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H14O3
Molecular Weight 242.2699
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:18:40 GMT 2023
Edited
by admin
on Sat Dec 16 19:18:40 GMT 2023
Record UNII
W59R466KWX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Dunnione, (S)-
Common Name English
SL-11010, (S)-
Code English
Naphtho[1,2-b]furan-4,5-dione, 2,3-dihydro-2,3,3-trimethyl-, (-)-
Systematic Name English
(-)-Dunnione
Common Name English
(-)-2,3-Dihydro-2,3,3-trimethylnaphtho[1,2-b]furan-4,5-dione
Systematic Name English
Code System Code Type Description
FDA UNII
W59R466KWX
Created by admin on Sat Dec 16 19:18:40 GMT 2023 , Edited by admin on Sat Dec 16 19:18:40 GMT 2023
PRIMARY
PUBCHEM
92144430
Created by admin on Sat Dec 16 19:18:40 GMT 2023 , Edited by admin on Sat Dec 16 19:18:40 GMT 2023
PRIMARY
CAS
521-49-3
Created by admin on Sat Dec 16 19:18:40 GMT 2023 , Edited by admin on Sat Dec 16 19:18:40 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER