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

Details

Stereochemistry ACHIRAL
Molecular Formula C16H16O6
Molecular Weight 304.2946
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CERULIGNONE

SMILES

COC1=CC(C=C(OC)C1=O)=C2C=C(OC)C(=O)C(OC)=C2

InChI

InChIKey=WASNBVDBYSQBPH-UHFFFAOYSA-N
InChI=1S/C16H16O6/c1-19-11-5-9(6-12(20-2)15(11)17)10-7-13(21-3)16(18)14(8-10)22-4/h5-8H,1-4H3

HIDE SMILES / InChI

Molecular Formula C16H16O6
Molecular Weight 304.2946
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 Sat Dec 16 12:43:18 GMT 2023
Edited
by admin
on Sat Dec 16 12:43:18 GMT 2023
Record UNII
752TWO2IP0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CERULIGNONE
Common Name English
(BI-2,5-CYCLOHEXADIEN-1-YLIDENE)-4,4'-DIONE, 3,3',5,5'-TETRAMETHOXY-
Systematic Name English
2,5-CYCLOHEXADIEN-1-ONE, 4-(3,5-DIMETHOXY-4-OXO-2,5-CYCLOHEXADIEN-1-YLIDENE)-2,6-DIMETHOXY-
Systematic Name English
COERULIGNONE
Common Name English
CEDRIRET
Common Name English
4-(3,5-DIMETHOXY-4-OXO-2,5-CYCLOHEXADIEN-1-YLIDENE)-2,6-DIMETHOXY-2,5-CYCLOHEXADIEN-1-ONE
Systematic Name English
NSC-401175
Code English
3,3',5,5'-TETRAMETHOXYDIPHENOQUINONE
Systematic Name English
3,3',5,5'-TETRAMETHOXY-P-BIPHENOQUINONE
Systematic Name English
DIPHENOQUINONE, 3,3',5,5'-TETRAMETHOXY-
Systematic Name English
COERULIGNON
Common Name English
Code System Code Type Description
NSC
401175
Created by admin on Sat Dec 16 12:43:18 GMT 2023 , Edited by admin on Sat Dec 16 12:43:18 GMT 2023
PRIMARY
PUBCHEM
136320
Created by admin on Sat Dec 16 12:43:18 GMT 2023 , Edited by admin on Sat Dec 16 12:43:18 GMT 2023
PRIMARY
CAS
493-74-3
Created by admin on Sat Dec 16 12:43:18 GMT 2023 , Edited by admin on Sat Dec 16 12:43:18 GMT 2023
PRIMARY
FDA UNII
752TWO2IP0
Created by admin on Sat Dec 16 12:43:18 GMT 2023 , Edited by admin on Sat Dec 16 12:43:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID00197762
Created by admin on Sat Dec 16 12:43:18 GMT 2023 , Edited by admin on Sat Dec 16 12:43:18 GMT 2023
PRIMARY
CHEBI
55496
Created by admin on Sat Dec 16 12:43:18 GMT 2023 , Edited by admin on Sat Dec 16 12:43:18 GMT 2023
PRIMARY