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Safety Information

SMB00247

Sigma-Aldrich

1,3,6-Trigalloylglucose

≥95% (LC/MS-ELSD)

Synonym(s):

1,3,6-Tri-O-galloyl-β-D-glucopyranose, 1,3,6-Tri-O-galloyl-β-D-glucose, Tannic acid (Corilagin)

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About This Item

Empirical Formula (Hill Notation):
C27H24O18
CAS Number:
18483-17-5
Molecular Weight:
636.47
MDL number:
MFCD06656305
UNSPSC Code:
12352200
PubChem Substance ID:
329824900
NACRES:
NA.25

Assay

≥95% (LC/MS-ELSD)

form

powder

application(s)

metabolomics
vitamins, nutraceuticals, and natural products

storage temp.

−20°C

SMILES string

O=C(C1=CC(O)=C(O)C(O)=C1)O[C@H]2[C@H](O)[C@@H](OC(C3=CC(O)=C(O)C(O)=C3)=O)[C@H](O)[C@@H](COC(C4=CC(O)=C(O)C(O)=C4)=O)O2

InChI

1S/C27H24O18/c28-11-1-8(2-12(29)18(11)34)24(39)42-7-17-21(37)23(44-25(40)9-3-13(30)19(35)14(31)4-9)22(38)27(43-17)45-26(41)10-5-15(32)20(36)16(33)6-10/h1-6,17,21-23,27-38H,7H2/t17-,21-,22-,23+,27+/m1/s1

InChI key

RNKMOGIPOMVCHO-SJMVAQJGSA-N

Related Categories

General description

Natural product derived from plant source.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Regulatory Information

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Danh C Vu et al.
Journal of agricultural and food chemistry, 66(17), 4503-4511 (2018-04-18)
Black walnuts ( Juglans nigra L.) are highly valued for producing phenolic-enriched nuts. The objectives of this study were to identify and characterize the phenolic contents of 11 different black walnut cultivars and compare the levels of these phenolics between
Alessia Panusa et al.
Phytochemistry, 115, 79-88 (2015-02-24)
The aim of this study was to get a rapid metabolic fingerprinting and to gain insight into the metabolic profiling of Arctostaphylos pungens H. B. K., a plant morphologically similar to Arctostaphylos uva-ursi (L.) Spreng. (bearberry) but with a lower

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