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Home > Product > Heterocyclic Organic Compounds > Neocarradodecaose 4(1),4(3),4(5),4(7),4(9),4(11)-hexasulfate hexasodium salt

Neocarradodecaose 4(1),4(3),4(5),4(7),4(9),4(11)-hexasulfate hexasodium salt | CAS Number: 133628-77-0

Catalog Number
AFI133628770
Product Name
Neocarradodecaose 4(1),4(3),4(5),4(7),4(9),4(11)-hexasulfate hexasodium salt
Structure
CAS Number
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
Synonyms
Neocarradodecaose 41,43,45,47,49,411-hexasulfate hexasodium salt, 133628-77-0
Molecular Weight
2467.88
Exact Mass
2466.21000
Molecular Formula
C72H104Na6O73S6
Purity
96%
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+]
InChIKey
YWSHUIVBCLNTEM-GGOYDXLKSA-H
H-Bond Donor
20
H-Bond Acceptor
73
WGK Germany
3
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