4-(2-Nitroethyl)phenol; O-[α-L-Arabinofuranosyl-(1→6)-β-D-glucopyranoside] 

AlkaPlorer ID: AK307867

Synonym: 6'-Arabinofuranosylthalictoside

IUPAC Name: None

Structure

SMILES: O=[N+]([O-])CCC1=CC=C(OC2OC(COC3OC(CO)C(O)C3O)C(O)C(O)C2O)C=C1

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InChI: InChI=1S/C19H27NO12/c21-7-11-13(22)16(25)18(31-11)29-8-12-14(23)15(24)17(26)19(32-12)30-10-3-1-9(2-4-10)5-6-20(27)28/h1-4,11-19,21-26H,5-8H2

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InChIKey: FRYHJHNDJMHODU-UHFFFAOYSA-N

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Reference

CAS: 887235-31-6

Properties Information

Molecule Weight: 461.4200000000001

TPSA: 201.44

MolLogP: -2.852199999999997

Number of H-Donors: 6

Number of H-Acceptors: 12

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information