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Key Documents

SMB00189

Sigma-Aldrich

Agnuside

≥95% (LC/MS-ELSD)

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About This Item

Empirical Formula (Hill Notation):
C22H26O11
CAS Number:
Molecular Weight:
466.44
UNSPSC Code:
12352205
PubChem Substance ID:
NACRES:
NA.25

assay

≥95% (LC/MS-ELSD)

form

solid

application(s)

metabolomics
vitamins, nutraceuticals, and natural products

storage temp.

−20°C

SMILES string

OC[C@H]1O[C@@H](OC2OC=C[C@H]3[C@H](O)C=C(COC(=O)c4ccc(O)cc4)[C@@H]23)[C@H](O)[C@@H](O)[C@@H]1O

InChI

1S/C22H26O11/c23-8-15-17(26)18(27)19(28)22(32-15)33-21-16-11(7-14(25)13(16)5-6-30-21)9-31-20(29)10-1-3-12(24)4-2-10/h1-7,13-19,21-28H,8-9H2/t13-,14+,15+,16+,17+,18-,19+,21?,22-/m0/s1

InChI key

GLACGTLACKLUJX-WMGXWGHESA-N

General description

Agnuside is an iridoid glycoside found in Vitex agnus-castus, a plant native to the Mediterranean region.

pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Acute Tox. 4 Oral

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable


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