4-(2-Nitroethyl)phenol; O-β-D-Glucopyranoside
AlkaPlorer ID: AK307870
Synonym: Thalictoside
IUPAC Name: 2-(hydroxymethyl)-6-[4-(2-nitroethyl)phenoxy]oxane-3,4,5-triol
Structure
SMILES: O=[N+]([O-])CCC1=CC=C(OC2OC(CO)C(O)C(O)C2O)C=C1
InChI: InChI=1S/C14H19NO8/c16-7-10-11(17)12(18)13(19)14(23-10)22-9-3-1-8(2-4-9)5-6-15(20)21/h1-4,10-14,16-19H,5-7H2
InChIKey: JRSACOBIDKCJGV-UHFFFAOYSA-N
Source
Properties Information
Molecule Weight: 329.305
TPSA？: 142.52
MolLogP？: -1.3155
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 2
Activities Information
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