Research chemical
CAS Number: 2600799-45-7
![Kaempferol-3-O-{beta-D-glucosyl-(1-->3)-[alpha-L-rhamnosyl (1-->6)]-beta-D-glucosyl}-7-O-beta-D-glucoside molecular structure, CAS 2600799-45-7](/structure-images/2600799-45-7.png?v=struct-v2)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
169450634
Exact Mass
918.264117
InChIKey
IAQYIRRDVMLQKZ-JDEZKSHDSA-N
IUPAC Name
3-[(2S,3R,4S,5R,6R)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
SMILES String
C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
Catalog navigation
Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.
Kaempferol-3-O-{beta-D-glucosyl-(1-->3)-[alpha-L-rhamnosyl (1-->6)]-beta-D-glucosyl}-7-O-beta-D-glucoside is identified by CAS 2600799-45-7, with molecular formula C39H50O25, molecular weight 918.8, InChIKey IAQYIRRDVMLQKZ-JDEZKSHDSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
64
H-bond acceptors
25
H-bond donors
15
Rotatable bonds
12
Ring count
7
Aromatic rings
3
Topological polar surface area
407.5 Ų
Computed LogP
-6.1
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
Kaempferol-3-O-{beta-D-glucosyl-(1-->3)-[alpha-L-rhamnosyl (1-->6)]-beta-D-glucosyl}-7-O-beta-D-glucoside (CAS 2600799-45-7) is maintained as a commercial cas reference with formula C39H50O25, molecular weight 918. 80 g/mol, PubChem CID 169450634.
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.