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Details

Stereochemistry ACHIRAL
Molecular Formula C7H7BrN4O2
Molecular Weight 259.06
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BROMOTHEOPHYLLINE

SMILES

CN1C2=C(NC(Br)=N2)C(=O)N(C)C1=O

InChI

InChIKey=SKTFQHRVFFOHTQ-UHFFFAOYSA-N
InChI=1S/C7H7BrN4O2/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14/h1-2H3,(H,9,10)

HIDE SMILES / InChI

Molecular Formula C7H7BrN4O2
Molecular Weight 259.06
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 Fri Dec 15 15:11:51 UTC 2023
Edited
by admin
on Fri Dec 15 15:11:51 UTC 2023
Record UNII
FZG87K1MQ6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BROMOTHEOPHYLLINE
Systematic Name English
8-BROMOTHEOPHYLLINE [USP-RS]
Common Name English
NSC-164940
Code English
8-BROMOTHEOPHYLLINE
USP-RS  
Systematic Name English
1H-PURINE-2,6-DIONE, 8-BROMO-3,9-DIHYDRO-1,3-DIMETHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
FZG87K1MQ6
Created by admin on Fri Dec 15 15:11:51 UTC 2023 , Edited by admin on Fri Dec 15 15:11:51 UTC 2023
PRIMARY
PUBCHEM
11808
Created by admin on Fri Dec 15 15:11:51 UTC 2023 , Edited by admin on Fri Dec 15 15:11:51 UTC 2023
PRIMARY
RXCUI
1546386
Created by admin on Fri Dec 15 15:11:51 UTC 2023 , Edited by admin on Fri Dec 15 15:11:51 UTC 2023
PRIMARY RxNorm
CAS
10381-75-6
Created by admin on Fri Dec 15 15:11:51 UTC 2023 , Edited by admin on Fri Dec 15 15:11:51 UTC 2023
PRIMARY
ECHA (EC/EINECS)
233-846-6
Created by admin on Fri Dec 15 15:11:51 UTC 2023 , Edited by admin on Fri Dec 15 15:11:51 UTC 2023
PRIMARY
DAILYMED
FZG87K1MQ6
Created by admin on Fri Dec 15 15:11:51 UTC 2023 , Edited by admin on Fri Dec 15 15:11:51 UTC 2023
PRIMARY
EPA CompTox
DTXSID7044768
Created by admin on Fri Dec 15 15:11:51 UTC 2023 , Edited by admin on Fri Dec 15 15:11:51 UTC 2023
PRIMARY
RS_ITEM_NUM
1077708
Created by admin on Fri Dec 15 15:11:51 UTC 2023 , Edited by admin on Fri Dec 15 15:11:51 UTC 2023
PRIMARY
DRUG BANK
DB14018
Created by admin on Fri Dec 15 15:11:51 UTC 2023 , Edited by admin on Fri Dec 15 15:11:51 UTC 2023
PRIMARY
NSC
164940
Created by admin on Fri Dec 15 15:11:51 UTC 2023 , Edited by admin on Fri Dec 15 15:11:51 UTC 2023
PRIMARY
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