Text Search
Structure Search

2,2,2-trifluoro-N-(2-{2-[2-(2-{[5-hydroxy-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}ethoxy)ethoxy]ethoxy}ethyl)acetamide

2,2,2-trifluoro-N-(2-{2-[2-(2-{[5-hydroxy-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}ethoxy)ethoxy]ethoxy}ethyl)acetamide

Formula: C28H48F3NO19

SMILES: CC1OC(OC2C(OCCOCCOCCOCCNC(=O)C(F)(F)F)OC(CO)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O

IUPAC: 2,2,2-trifluoro-N-(2-{2-[2-(2-{[5-hydroxy-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}ethoxy)ethoxy]ethoxy}ethyl)acetamide

InChI: InChI=1/C28H48F3NO19/c1-12-15(35)18(38)20(40)24(47-12)51-23-22(50-25-21(41)19(39)16(36)13(10-33)48-25)17(37)14(11-34)49-26(23)46-9-8-45-7-6-44-5-4-43-3-2-32-27(42)28(29,30)31/h12-26,33-41H,2-11H2,1H3,(H,32,42)

Composition: C (44.27%), H (6.37%), F (7.50%), N (1.84%), O (40.01%)

Molar Mass: 759.675

Atom Count: 99

Heavy Atom Count: 51

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 15
Exact Mass 759.277262819
Formal Charge 0
FSP3 0.96
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 19
Hydrogen Bond Donor Count 10
InChIKey JWUOIEKNQHHZMW-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 155.49
Topological Polar Surface Area 294.24
Polarizability 63.5
Ring Count 3
Rotatable Bond Count 20

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <14 Days C28H48F3NO19 Quote Only