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Chemical structure of Aristolochic acid B

GC35389

Aristolochic acid B

Also known as 6-nitronaphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid

An alkaloid with mutagenic activity

ChemicalCAS475-80-9MW311.25FormulaC16H9NO6
CAS number
475-80-9
Molecular weight
311.25
Formula
C16H9NO6
Solubility
DMSO: 25 mg/ml,Ethanol: Soluble,Water: Slightly Soluble
InChIKey
MEEXETVZNQYRSP-UHFFFAOYSA-N
Catalogue number
GC35389
Brand
GLPBIO
Computed properties PubChem CID 108168 · XLogP 3.6 · TPSA 102 Ų · H-bond donors 1
XLogP
3.6
TPSA
102 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
1
Heavy atoms
23

SMILES C1OC2=C(O1)C3=C(C(=C2)C(=O)O)C(=CC4=CC=CC=C43)[N+](=O)[O-]

Computed descriptors from PubChem (CID 108168), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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