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6837-93-0

6837-93-0 structure
6837-93-0 structure
  • Name: NSC16168
  • Chemical Name: 4-amino-5-(4-methylphenyl)sulfonyloxynaphthalene-2,7-disulfonic acid
  • CAS Number: 6837-93-0
  • Molecular Formula: C17H15NO9S3
  • Molecular Weight: 473.49700
  • Catalog: Research Areas Cancer
  • Create Date: 2016-05-08 03:59:32
  • Modify Date: 2024-01-09 10:49:15
  • NSC16168 is a specific inhibitor of ERCC1-XPF, with an IC50 value of 0.42 μM. NSC16168 inhibits DNA repair and potentiates CDDP efficacy in cancer[1].

Name 4-amino-5-(4-methylphenyl)sulfonyloxynaphthalene-2,7-disulfonic acid
Synonyms Kyselina o-tosyl-h
1-Amino-3,6-disulfo-8-naftylester kyselina p-toluensulfonove
Kyselina O-tosyl-H [Czech]
4-AMINO-5-(TOSYLOXY)NAPHTHALENE-2,7-DISULFONIC ACID
Description NSC16168 is a specific inhibitor of ERCC1-XPF, with an IC50 value of 0.42 μM. NSC16168 inhibits DNA repair and potentiates CDDP efficacy in cancer[1].
Related Catalog
Target

IC50: 0.42 μM (ERCC1-XPF)[1].

References

[1]. Arora S, et al. Identification of small molecule inhibitors of ERCC1-XPF that inhibit DNA repair and potentiate cisplatin efficacy in cancer cells. Oncotarget. 2016 Nov 15;7(46):75104-75117.

Density 1.683g/cm3
Molecular Formula C17H15NO9S3
Molecular Weight 473.49700
Exact Mass 472.99100
PSA 203.27000
LogP 5.81510
Index of Refraction 1.698

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QJ6250000
CHEMICAL NAME :
2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-, p-toluenesulfonate (ester)
CAS REGISTRY NUMBER :
6837-93-0
BEILSTEIN REFERENCE NO. :
3124026
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C17-H15-N-O9-S3
MOLECULAR WEIGHT :
473.51
WISWESSER LINE NOTATION :
L66J BZ DSWQ HSWQ JOSWR D1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,1063,1986 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
11500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,1063,1986
Hazard Codes Xi
HS Code 2922199090
HS Code 2922199090
Summary 2922199090. other amino-alcohols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%