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Details

Stereochemistry ACHIRAL
Molecular Formula C11H8BrO4.Na
Molecular Weight 307.073
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of SODIUM BROMEBRATE

SMILES

[Na+].COC1=CC=C(C=C1)C(=O)C(\Br)=C/C([O-])=O

InChI

InChIKey=DVDCIQWIGOVWEX-MLBSPLJJSA-M
InChI=1S/C11H9BrO4.Na/c1-16-8-4-2-7(3-5-8)11(15)9(12)6-10(13)14;/h2-6H,1H3,(H,13,14);/q;+1/p-1/b9-6+;

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C11H8BrO4
Molecular Weight 284.083
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Bromebric Acid (Cytembena) is a derivative of bromoacrylic acid with cytostatic and antineoplastic activity. Chemical structure of Bromebric Acid is not related to any previous antineoplastic agent. In animal tumor screens, Jelinek and Semonsky noted antineoplastic activity of Cytembena against sarcoma 180, atlenocarcinoina of the lactic gland in mice, Ehrlich’s ascitic carcinoma, Yoshida’s ascitic sarcoma, and Zojdeln’s heap

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:25:19 GMT 2023
Edited
by admin
on Sat Dec 16 09:25:19 GMT 2023
Record UNII
9V238C7BMX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM BROMEBRATE
Common Name English
NSC-104801
Code English
CYTEMBENA
Brand Name English
BROMEBRIC ACID SODIUM SALT
Common Name English
CYTEMBENE
Brand Name English
2-BUTENOIC ACID, 3-BROMO-4-(4-METHOXYPHENYL)-4-OXO-, SODIUM SALT (1:1), (2E)-
Systematic Name English
(E)-3-(P-ANISOYL)-3-BROMOACRYLIC ACID, SODIUM SALT
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C272
Created by admin on Sat Dec 16 09:25:19 GMT 2023 , Edited by admin on Sat Dec 16 09:25:19 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID40273998
Created by admin on Sat Dec 16 09:25:19 GMT 2023 , Edited by admin on Sat Dec 16 09:25:19 GMT 2023
PRIMARY
CAS
21739-91-3
Created by admin on Sat Dec 16 09:25:19 GMT 2023 , Edited by admin on Sat Dec 16 09:25:19 GMT 2023
PRIMARY
FDA UNII
9V238C7BMX
Created by admin on Sat Dec 16 09:25:19 GMT 2023 , Edited by admin on Sat Dec 16 09:25:19 GMT 2023
PRIMARY
PUBCHEM
23665583
Created by admin on Sat Dec 16 09:25:19 GMT 2023 , Edited by admin on Sat Dec 16 09:25:19 GMT 2023
PRIMARY
SMS_ID
100000092633
Created by admin on Sat Dec 16 09:25:19 GMT 2023 , Edited by admin on Sat Dec 16 09:25:19 GMT 2023
PRIMARY
NCI_THESAURUS
C1360
Created by admin on Sat Dec 16 09:25:19 GMT 2023 , Edited by admin on Sat Dec 16 09:25:19 GMT 2023
PRIMARY NCIT
HSDB
4134
Created by admin on Sat Dec 16 09:25:19 GMT 2023 , Edited by admin on Sat Dec 16 09:25:19 GMT 2023
PRIMARY
CAS
16170-75-5
Created by admin on Sat Dec 16 09:25:19 GMT 2023 , Edited by admin on Sat Dec 16 09:25:19 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
NSC
104801
Created by admin on Sat Dec 16 09:25:19 GMT 2023 , Edited by admin on Sat Dec 16 09:25:19 GMT 2023
PRIMARY
EVMPD
SUB26045
Created by admin on Sat Dec 16 09:25:19 GMT 2023 , Edited by admin on Sat Dec 16 09:25:19 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY