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SMB00254

3,4-Di-O-galloylshikimic acid

≥85% (LC/MS-ELSD)

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About This Item

Empirical Formula (Hill Notation):
C21H18O13
CAS Number:
95753-51-8
Molecular Weight:
478.36
UNSPSC Code:
12352205
PubChem Substance ID:
329824906
NACRES:
NA.25
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assay

≥85% (LC/MS-ELSD)

form

solid

application(s)

metabolomics
vitamins, nutraceuticals, and natural products

storage temp.

−20°C

SMILES string

O[C@@H]1C=C(C[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H]1OC(=O)c3cc(O)c(O)c(O)c3)C(O)=O

InChI

1S/C21H18O13/c22-10-2-8(3-11(23)16(10)27)20(31)33-15-6-7(19(29)30)1-14(26)18(15)34-21(32)9-4-12(24)17(28)13(25)5-9/h1-5,14-15,18,22-28H,6H2,(H,29,30)/t14-,15-,18-/m1/s1

InChI key

UFDJVOQZZQZYJG-IIDMSEBBSA-N

General description

Natural product derived from plant source.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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