2-O-glucuronyl-7-O-(2-amino-2-deoxyglucopyranosyl)heptose

6-[7-[3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydroxy-1-oxoheptan-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

Also Known As: Sid 769145|2-amino-2-deoxyhexopyranosyl-(1-|2-amino-2-deoxyhexopyranosyl-(1->7)-[hexopyranuronosyl-(1->2)]heptose|2-O-Glucuronyl-7-O-(2-amino-2-deoxyglucopyranosyl)heptose|6-[7-[3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydroxy-1-oxoheptan-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid|2-O-(beta-D-Glucuronyl)-7-O-(2-amino-2-deoxy-alpha-D-glucopyranosyl)-L-glycero-D-manno-heptose|L-glycero-D-manno-Heptose, O-2-amino-2-deoxy-alpha-D-glucopyranosyl-(1-7)-O-(beta-D-glucopyranuronosyl-(1-2))-

Molecular Formula	C19H33NO17
Molecular Weight	547.17487 g/mol
LogP	-9.5
Topological Polar Surface Area	320.0 Ų
Hydrogen Bond Donors	12
Hydrogen Bond Acceptors	18
Rotatable Bonds	12
Exact Mass	547.17487
Monoisotopic Mass	547.17487
Heavy Atoms	37
Complexity	745.0

Chemical Identifiers

CAS Number	7290-99-5
SMILES	C(C1C(C(C(C(O1)OCC(C(C(C(C(C=O)OC2C(C(C(C(O2)C(=O)O)O)O)O)O)O)O)O)N)O)O)O
InChIKey	ZJNWPQVNOBCTSX-UHFFFAOYSA-N