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About This Item
Empirical Formula (Hill Notation):
C17H10NNaO7
CAS Number:
Molecular Weight:
363.25
NACRES:
NA.77
PubChem Substance ID:
UNSPSC Code:
12352202
EC Number:
233-463-4
MDL number:
Assay:
≥97%
Form:
powder
Solubility:
H2O: 50 mg/mL
Quality Segment
assay
≥97%
form
powder
solubility
H2O: 50 mg/mL
SMILES string
[Na+].COc1cccc2c1cc([N+]([O-])=O)c3c(cc4OCOc4c23)C([O-])=O
InChI
1S/C17H11NO7.Na/c1-23-12-4-2-3-8-9(12)5-11(18(21)22)14-10(17(19)20)6-13-16(15(8)14)25-7-24-13;/h2-6H,7H2,1H3,(H,19,20);/q;+1/p-1
InChI key
BQVOPWJSBBMGBR-UHFFFAOYSA-M
Biochem/physiol Actions
Component of some Chinese herbal medicines, and responsible for their nephrotoxicity. Prodrug activated by reduction of the nitro group to an amine, which forms cytotoxic DNA adducts.
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Carc. 2
Storage Class
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
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