Agnuside, 99.90%

cas: 11027-63-7 — see every product listed under this CAS number, including other names

Agnuside, 99.90% (CAS 11027-63-7) is a chemical reagent available from Chemat. Available pack sizes: 10mM/1mL, 10 mg, 1 mg, 5 mg. Offered by: MedChemExpress.

brandMedChemExpress
catalog numberHY-N2518-10mM/1mL
cas11027-63-7
size10mM/1mL
availability In stock
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Available pack sizes

brand size price
MedChemExpress 10mM/1mL 788.74 Pln
MedChemExpress 10 mg 1174.19 Pln
MedChemExpress 1 mg 361.49 Pln
MedChemExpress 5 mg 765.52 Pln

properties

delivery time 2-3 weeks
purity99.90%
Structural formula: {0} (CAS {1})

Agnuside is a benzoate ester resulting from the formal condensation of the carboxy group of 4-hydroxybenzoic acid with the primary hydroxy group of aucubin. It is an iridoid glycoside found in several Vitex plants including Vitex agnus-castus. It has a role as a cyclooxygenase 2 inhibitor, an anti-inflammatory agent, a pro-angiogenic agent and a plant metabolite. It is a beta-D-glucoside, a member of phenols, a benzoate ester, a cyclopentapyran, an iridoid monoterpenoid, a terpene glycoside and a monosaccharide derivative. It is functionally related to an aucubin.

Source: ChEBI

Identity
Molecular formulaC22H26O11
Molecular weight466.4 g/mol
IUPAC name[(1S,4aR,5S,7aS)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl 4-hydroxybenzoate
InChIKeyGLACGTLACKLUJX-QNAXTHAFSA-N
SMILESC1=CO[C@H]([C@H]2[C@@H]1[C@@H](C=C2COC(=O)C3=CC=C(C=C3)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O

Computed by PubChem (NCBI)

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