Research chemical
CAS Number: 133628-75-8
PubChem CID
90469780
Exact Mass
2058.179772
InChIKey
MMYDVHSZORPFRF-VLBKFVCYSA-I
IUPAC Name
pentasodium;[(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-[(3R,4R,5S,6R)-2,3-dihydroxy-6-(hydroxymethyl)-5-sulfonatooxyoxan-4-yl]oxy-4-hydroxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-3-hydroxy-6-(hydroxymethyl)-5-sulfonatooxyoxan-4-yl]oxy-4-hydroxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-3-hydroxy-6-(hydroxymethyl)-5-sulfonatooxyoxan-4-yl]oxy-4-hydroxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-3-hydroxy-6-(hydroxymethyl)-5-sulfonatooxyoxan-4-yl]oxy-4-hydroxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-5-hydroxy-2-(hydroxymethyl)oxan-3-yl] sulfate
SMILES String
O=S(=O)([O-])O[C@@H]1[C@H](O[C@H]2O[C@@H]3CO[C@@H]([C@H]3O)[C@H]2O)[C@@H](O)[C@H](O[C@@H]2[C@@H]3OC[C@H]2O[C@H](O[C@@H]2[C@@H](O)[C@H](O[C@@H]4[C@@H]5OC[C@H]4O[C@H](O[C@@H]4[C@@H](O)[C@H](O[C@@H]6[C@@H]7OC[C@H]6O[C@H](O[C@@H]6[C@@H](O)[C@H](O[C@@H]8[C@@H]9OC[C@H]8O[C@H](O[C@H]8[C@@H](OS(=O)(=O)[O-])[C@@H](CO)OC(O)[C@@H]8O)[C@@H]9O)O[C@H](CO)[C@@H]6OS(=O)(=O)[O-])[C@@H]7O)O[C@H](CO)[C@@H]4OS(=O)(=O)[O-])[C@@H]5O)O[C@H](CO)[C@@H]2OS(=O)(=O)[O-])[C@@H]3O)O[C@@H]1CO.[Na+].[Na+].[Na+].[Na+].[Na+]
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
Neocarrabiose4 1,3,5,7,9-penta-O-sulphate (NA+) is identified by CAS 133628-75-8, with molecular formula C60H87Na5O61S5, molecular weight 2059.6, InChIKey MMYDVHSZORPFRF-VLBKFVCYSA-I.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.
Availability, pack size, lead time, and pricing are confirmed through RFQ.
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.
Pricing and stock are confirmed on request.
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Product details
For laboratory research and professional procurement workflows.
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
131
H-bond acceptors
61
H-bond donors
17
Rotatable bonds
33
Ring count
15
Aromatic rings
0
Topological polar surface area
897.58 Ų
Computed LogP
-35.13
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
other structure rule
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
No
Boronic acid motif
No
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Structural features
Neocarrabiose4 1,3,5,7,9-penta-O-sulphate (NA+) (CAS 133628-75-8) is maintained as a commercial cas reference with formula C60H87Na5O61S5, molecular weight 2059. 60 g/mol, PubChem CID 90469780.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for CAS identity lookup, internal catalog search, and commercial discovery workflows.
Documentation needs
Review supplier documentation before handling; for research use only.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.