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

Details

Stereochemistry RACEMIC
Molecular Formula C17H16O5
Molecular Weight 300.3059
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6H-Benzofuro[3,2-c][1]benzopyran-8-ol, 6a,11a-dihydro-3,9-dimethoxy-, cis-

SMILES

[H][C@]12COC3=CC(OC)=CC=C3[C@@]1([H])OC4=CC(OC)=C(O)C=C24

InChI

InChIKey=KIKDCPYSYOMXEJ-SJKOYZFVSA-N
InChI=1S/C17H16O5/c1-19-9-3-4-10-14(5-9)21-8-12-11-6-13(18)16(20-2)7-15(11)22-17(10)12/h3-7,12,17-18H,8H2,1-2H3/t12-,17-/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H16O5
Molecular Weight 300.3059
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 Sat Dec 16 16:37:17 GMT 2023
Edited
by admin
on Sat Dec 16 16:37:17 GMT 2023
Record UNII
G7D6YM3UF2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6H-Benzofuro[3,2-c][1]benzopyran-8-ol, 6a,11a-dihydro-3,9-dimethoxy-, cis-
Systematic Name English
Code System Code Type Description
FDA UNII
G7D6YM3UF2
Created by admin on Sat Dec 16 16:37:17 GMT 2023 , Edited by admin on Sat Dec 16 16:37:17 GMT 2023
PRIMARY
CAS
152611-67-1
Created by admin on Sat Dec 16 16:37:17 GMT 2023 , Edited by admin on Sat Dec 16 16:37:17 GMT 2023
PRIMARY
PUBCHEM
468919
Created by admin on Sat Dec 16 16:37:17 GMT 2023 , Edited by admin on Sat Dec 16 16:37:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID80165085
Created by admin on Sat Dec 16 16:37:17 GMT 2023 , Edited by admin on Sat Dec 16 16:37:17 GMT 2023
PRIMARY