Sodium aristolochate

Catalog Number	ACM10190995-1
CAS Number	10190-99-5
Structure
Synonyms	Aristolochic acid sodium salt
IUPAC Name	Sodium;8-methoxy-6-nitronaphtho[2,1-g][1,3]benzodioxole-5-carboxylate
Molecular Weight	363.25
Molecular Formula	C17H10NNaO7
Canonical SMILES	COC1=CC=CC2=C3C(=C(C=C21)[N+](=O)[O-])C(=CC4=C3OCO4)C(=O)[O-].[Na+]
InChI	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
Purity	97%+ (HPLC)
Storage	Store in dry, low temperature, sealed, 2-8 °C.
Complexity	544
Exact Mass	363.03549594
Heavy Atom Count	26
Monoisotopic Mass	363.03549594
Topological Polar Surface Area	114Ų

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