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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H14O10
Molecular Weight 414.3192
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-ACETYL-6-ETHYL-9,10-DIHYDRO-3,5,8-TRIHYDROXY-9,10-DIOXO-1,2-ANTHRACENEDICARBOXYLIC ACID

SMILES

CCC1=C(O)C2=C(C(=O)C3=C(C(O)=O)C(C(O)=O)=C(O)C=C3C2=O)C(O)=C1C(C)=O

InChI

InChIKey=RHAXKFFKGZJUOE-UHFFFAOYSA-N
InChI=1S/C20H14O10/c1-3-6-9(5(2)21)17(25)14-13(15(6)23)16(24)7-4-8(22)11(19(27)28)12(20(29)30)10(7)18(14)26/h4,22-23,25H,3H2,1-2H3,(H,27,28)(H,29,30)

HIDE SMILES / InChI

Molecular Formula C20H14O10
Molecular Weight 414.3192
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 20:11:07 GMT 2023
Edited
by admin
on Sat Dec 16 20:11:07 GMT 2023
Record UNII
Y6645RV9DR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-ACETYL-6-ETHYL-9,10-DIHYDRO-3,5,8-TRIHYDROXY-9,10-DIOXO-1,2-ANTHRACENEDICARBOXYLIC ACID
Systematic Name English
LACCAIC ACID
INCI  
Official Name English
1,2-ANTHRACENEDICARBOXYLIC ACID, 7-ACETYL-6-ETHYL-9,10-DIHYDRO-3,5,8-TRIHYDROXY-9,10-DIOXO-
Systematic Name English
LACCAIC ACID [INCI]
Common Name English
NSC-170008
Code English
NSC-30555
Code English
Code System Code Type Description
NSC
170008
Created by admin on Sat Dec 16 20:11:08 GMT 2023 , Edited by admin on Sat Dec 16 20:11:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID3064140
Created by admin on Sat Dec 16 20:11:08 GMT 2023 , Edited by admin on Sat Dec 16 20:11:08 GMT 2023
PRIMARY
ECHA (EC/EINECS)
228-289-0
Created by admin on Sat Dec 16 20:11:08 GMT 2023 , Edited by admin on Sat Dec 16 20:11:08 GMT 2023
PRIMARY
CHEBI
90184
Created by admin on Sat Dec 16 20:11:08 GMT 2023 , Edited by admin on Sat Dec 16 20:11:08 GMT 2023
PRIMARY
NSC
30555
Created by admin on Sat Dec 16 20:11:08 GMT 2023 , Edited by admin on Sat Dec 16 20:11:08 GMT 2023
PRIMARY
PUBCHEM
5355255
Created by admin on Sat Dec 16 20:11:08 GMT 2023 , Edited by admin on Sat Dec 16 20:11:08 GMT 2023
PRIMARY
FDA UNII
Y6645RV9DR
Created by admin on Sat Dec 16 20:11:08 GMT 2023 , Edited by admin on Sat Dec 16 20:11:08 GMT 2023
PRIMARY
CAS
6219-66-5
Created by admin on Sat Dec 16 20:11:08 GMT 2023 , Edited by admin on Sat Dec 16 20:11:08 GMT 2023
PRIMARY