Agnuside

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

Agnuside (CAS 11027-63-7) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 1mg, 50mg, 25mg, 5mg, 100mg, 250mg. Offered by: TRC, GLPBio, Biosynth.

brandTRC
catalog numberTRC-A427020-10MG
cas11027-63-7
size10mg
Need more information?

Ask us about this product — we're happy to help.

Available pack sizes

brand size price
TRC 10mg price on request
TRC 1mg price on request
TRC 50mg price on request
GLPBio 1mg 685.97 Pln
GLPBio 10mg 1645.47 Pln
GLPBio 25mg 3138.55 Pln
GLPBio 5mg 1163.38 Pln
Biosynth 25mg price on request
Biosynth 10mg price on request
Biosynth 50mg price on request
Biosynth 100mg price on request
Biosynth 250mg price on request

properties

purityNo data
delivery timeTo be confirmed by Chemat
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)

Synonyms: Agnuside, Buddlejoside A, (-)-Buddlejoside A, Agnoside, MEGxp0_000767, Agnusid, Agnuside (Standard), AGNUSIDE [USP-RS], orb1221234, orb1303636
Isomers (same molecular formula)
[5-hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,6-dimethoxybenzoate C22H26O11
[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-(4-acetylphenoxy)oxan-2-yl]methyl acetate C22H26O11
[(1S,4aR,5S,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-5-yl] 4-hydroxybenzoate C22H26O11
1-[2,6-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)propan-1-one C22H26O11

Also listed as

Agnuside, 95% Combi-blocks CAS 11027-63-7
Agnuside/ 98.98% (existing batch purity) TargetMol CAS 11027-63-7
Agnuside 98% Ambeed CAS 11027-63-7
Agnuside, 98%, 98% Chemat CAS 11027-63-7
Agnuside, 99.90% MedChemExpress CAS 11027-63-7
Agnuside (Standard) MedChemExpress CAS 11027-63-7
Agnuside, ROTICHROM® HPLC, 10 mg, glass Roth CAS 11027-63-7
Agnuside, 97% Fluorochem CAS 11027-63-7