4-Hydroxybenzyl isothiocyanate; O-α-L-Rhamnopyranoside 

AlkaPlorer ID: AK300886

Synonym: None

IUPAC Name: 2-[4-(isothiocyanatomethyl)phenoxy]-6-methyloxane-3,4,5-triol

Structure

SMILES: CC1OC(OC2=CC=C(CN=C=S)C=C2)C(O)C(O)C1O

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InChI: InChI=1S/C14H17NO5S/c1-8-11(16)12(17)13(18)14(19-8)20-10-4-2-9(3-5-10)6-15-7-21/h2-5,8,11-14,16-18H,6H2,1H3

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InChIKey: QAZIHHJTZPNRCM-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 311.359

TPSA: 91.51

MolLogP: 0.4956999999999998

Number of H-Donors: 3

Number of H-Acceptors: 7

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information