rhodamine6G – Rhodamine 6G

Name
WID rhodamine6G View in model
Name Rhodamine 6G View in model
Traditional name rhodamine 6g
IUPAC name 9-[2-(ethoxycarbonyl)phenyl]-N-ethyl-6-(ethylamino)-2,7-dimethyl-3H-xanthen-3-iminium
Cross references ChEBI: 52895, PubChem: 85164765, KEGG: C11177
 
Classification
Type antibiotic View in model
 
Structure
Empirical formula (pH 7.5) H31C28N2O3
SMILES (pH 7.5) CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C
Charge (pH 7.5) 0
Is hydrophobic False View in model
Molecular weight (Da) 443.56 View in model
van der Waals volume 
(pH 7.5; Å3 molecule‑1)
420.09
ΔfG'o (pH 7.5, 25C, I = 0; kJ mol‑1) 1820.60
logP 5.35
logD (pH 7.5) 5.32
 
Function
Reaction participant drug efflux (rhodamine 6G) via sodium antiport
NA[e] + rhodamine6G[c] ⇒ NA[c] + rhodamine6G[e]
View in model
 
Metadata
Created 2012-10-01 15:07:07
Last updated 2012-10-01 15:12:30