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Details

Stereochemistry RACEMIC
Molecular Formula C17H16O4
Molecular Weight 284.3065
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6a,11a-Dihydro-3,9-dimethoxy-6H-benzofuro[3,2-c][1]benzopyran, rel-(6aR,11aS)-

SMILES

COC1=CC2=C(C=C1)[C@@H]3COC4=C(C=CC(OC)=C4)[C@H]3O2

InChI

InChIKey=VPGIGLKLCFOWDN-WMLDXEAASA-N
InChI=1S/C17H16O4/c1-18-10-4-6-13-15(7-10)20-9-14-12-5-3-11(19-2)8-16(12)21-17(13)14/h3-8,14,17H,9H2,1-2H3/t14-,17+/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H16O4
Molecular Weight 284.3065
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:22:39 GMT 2025
Edited
by admin
on Wed Apr 02 19:22:39 GMT 2025
Record UNII
AEK7QS8V99
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6a,11a-Dihydro-3,9-dimethoxy-6H-benzofuro[3,2-c][1]benzopyran, rel-(6aR,11aS)-
Systematic Name English
6H-Benzofuro[3,2-c][1]benzopyran, 6a,11a-dihydro-3,9-dimethoxy-, (6aR,11aS)-rel-
Preferred Name English
rel-(6aR,11aS)-6a,11a-Dihydro-3,9-dimethoxy-6H-benzofuro[3,2-c][1]benzopyran
Systematic Name English
Code System Code Type Description
PUBCHEM
50989259
Created by admin on Wed Apr 02 19:22:39 GMT 2025 , Edited by admin on Wed Apr 02 19:22:39 GMT 2025
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FDA UNII
AEK7QS8V99
Created by admin on Wed Apr 02 19:22:39 GMT 2025 , Edited by admin on Wed Apr 02 19:22:39 GMT 2025
PRIMARY
CAS
2705159-67-5
Created by admin on Wed Apr 02 19:22:39 GMT 2025 , Edited by admin on Wed Apr 02 19:22:39 GMT 2025
PRIMARY