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Details

Stereochemistry ACHIRAL
Molecular Formula C15H10BrNO2
Molecular Weight 316.149
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-AMINO-4-BROMO-2-METHYLANTHRAQUINONE

SMILES

CC1=C(N)C2=C(C(Br)=C1)C(=O)C3=CC=CC=C3C2=O

InChI

InChIKey=VIQMJMDPUIBXQO-UHFFFAOYSA-N
InChI=1S/C15H10BrNO2/c1-7-6-10(16)11-12(13(7)17)15(19)9-5-3-2-4-8(9)14(11)18/h2-6H,17H2,1H3

HIDE SMILES / InChI

Molecular Formula C15H10BrNO2
Molecular Weight 316.149
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Structure-activity relationships of anthraquinone derivatives derived from bromaminic acid as inhibitors of ectonucleoside triphosphate diphosphohydrolases (E-NTPDases).
2009 Mar
Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:46:48 GMT 2023
Edited
by admin
on Fri Dec 15 17:46:48 GMT 2023
Record UNII
K495LUA00R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-AMINO-4-BROMO-2-METHYLANTHRAQUINONE
Systematic Name English
1-AMINO-3-BROMO-2-METHYL-9,10-ANTHRAQUINONE
Systematic Name English
1-AMINO-2-METHYL-4-BROMO-9,10-ANTHRAQUINONE
Systematic Name English
9,10-ANTHRACENEDIONE, 1-AMINO-4-BROMO-2-METHYL-
Systematic Name English
4-BROMO-2-METHYL-1-ANTHRAQUINONYLAMINE
Systematic Name English
ANTHRAQUINONE, 1-AMINO-4-BROMO-2-METHYL-
Systematic Name English
NSC-401160
Code English
Code System Code Type Description
EPA CompTox
DTXSID1058848
Created by admin on Fri Dec 15 17:46:48 GMT 2023 , Edited by admin on Fri Dec 15 17:46:48 GMT 2023
PRIMARY
NSC
401160
Created by admin on Fri Dec 15 17:46:48 GMT 2023 , Edited by admin on Fri Dec 15 17:46:48 GMT 2023
PRIMARY
FDA UNII
K495LUA00R
Created by admin on Fri Dec 15 17:46:48 GMT 2023 , Edited by admin on Fri Dec 15 17:46:48 GMT 2023
PRIMARY
ECHA (EC/EINECS)
201-355-6
Created by admin on Fri Dec 15 17:46:48 GMT 2023 , Edited by admin on Fri Dec 15 17:46:48 GMT 2023
PRIMARY
PUBCHEM
66480
Created by admin on Fri Dec 15 17:46:48 GMT 2023 , Edited by admin on Fri Dec 15 17:46:48 GMT 2023
PRIMARY
CAS
81-50-5
Created by admin on Fri Dec 15 17:46:48 GMT 2023 , Edited by admin on Fri Dec 15 17:46:48 GMT 2023
PRIMARY