2-[(2-acetamido-4-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,5,6-trihydroxyhexyl)amino]benzamide

2-[(2-acetamido-4-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,5,6-trihydroxyhexyl)amino]benzamide

Formula: C23H36N4O11

SMILES: CC(=O)NC(CNC1=CC=CC=C1C(N)=O)C(O)C(OC1OC(CO)C(O)C(O)C1NC(C)=O)C(O)CO

IUPAC: 2-[(2-acetamido-4-{[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,5,6-trihydroxyhexyl)amino]benzamide

InChI: InChI=1/C23H36N4O11/c1-10(30)26-14(7-25-13-6-4-3-5-12(13)22(24)36)18(33)21(15(32)8-28)38-23-17(27-11(2)31)20(35)19(34)16(9-29)37-23/h3-6,14-21,23,25,28-29,32-35H,7-9H2,1-2H3,(H2,24,36)(H,26,30)(H,27,31)

Composition: C (50.73%), H (6.66%), N (10.29%), O (32.32%)

Molar Mass: 544.558

Atom Count: 74

Heavy Atom Count: 38

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	9
Exact Mass	544.238057995
Formal Charge	0
FSP3	0.61
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	12
Hydrogen Bond Donor Count	10
InChIKey	WDUINBKGHSLVKZ-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	130.09
Topological Polar Surface Area	253.16
Polarizability	50.92
Ring Count	2
Rotatable Bond Count	13

Suppliers

Molecule Market Select

Purity	LeadTime	Formula		UnitPrice
98%	<14 Days	C23H36N4O11		Quote Only