Neocarradodecaose 4(1),4(3),4(5),4(7),4(9),4(11)-hexasulfate hexasodium salt

Catalog Number

ACM133628770

Product Name

Neocarradodecaose 4(1),4(3),4(5),4(7),4(9),4(11)-hexasulfate hexasodium salt

Structure

CAS

133628-77-0

Category

Heterocyclic Organic Compound

Synonyms

Neocarradodecaose 41,43,45,47,49,411-hexasulfate hexasodium salt, 133628-77-0

IUPAC Name

hexasodium;[(2R,3S,4R,5R,6S)-4-[[(1R,3R,4R,5S,8S)-4,8-dihydroxy-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-6-[[(1R,3R,4R,5R,8S)-3-[(2S,3R,4R,5S,6R)-2-[[(1R,3R,4R,5R,8S)-3-[(2S,3R,4R,5S,6R)-2-[[(1R,3R,4R,5R,8S)-3-[(2S,3R,4R,5S,6R)-2-[[(1R,3R,4R,5R,8S)-3-[(2S,3

Molecular Weight

2467.88

Molecular Formula

C₇₂H₁₀₄Na₆O₇₃S₆

Canonical SMILES

C1C2C(C(O1)C(C(O2)OC3C(C(OC(C3OS(=O)(=O)[O-])CO)OC4C5COC4C(C(O5)OC6C(C(OC(C6OS(=O)(=O)[O-])CO)OC7C8COC7C(C(O8)OC9C(C(OC(C9OS(=O)(=O)[O-])CO)OC1C2COC1C(C(O2)OC1C(C(OC(C1OS(=O)(=O)[O-])CO)OC1C2COC1C(C(O2)OC1C(C(OC(C1OS(=O)(=O)[O-])CO)OC1C2COC1C(C(O2)OC1C(C(OC(C1OS(=O)(=O)[O-])CO)O)O)O)O)O)O)O)O)O)O)O)O)O)O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]

InChI Key

YWSHUIVBCLNTEM-GGOYDXLKSA-H

Exact Mass

2466.21000

H-Bond Acceptor

73

H-Bond Donor

20

WGK Germany

3

MSDS

COA

Spec Sheet