NP-003686

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C34H28O22
Molecular Weight	788.5729
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O[C@@H]1[C@@H](COC(=O)C2=CC(O)=C(O)C(O)=C2)O[C@@H](OC(=O)C3=CC(O)=C(O)C(O)=C3)[C@H](OC(=O)C4=CC(O)=C(O)C(O)=C4)[C@H]1OC(=O)C5=CC(O)=C(O)C(O)=C5

InChI

InChIKey=RATQVALKDAUZBW-XPMKZLBQSA-N

InChI=1S/C34H28O22/c35-14-1-10(2-15(36)23(14)43)30(48)52-9-22-27(47)28(54-31(49)11-3-16(37)24(44)17(38)4-11)29(55-32(50)12-5-18(39)25(45)19(40)6-12)34(53-22)56-33(51)13-7-20(41)26(46)21(42)8-13/h1-8,22,27-29,34-47H,9H2/t22-,27-,28+,29-,34+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C34H28O22
Molecular Weight	788.5729
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
Inhibition of human immunodeficiency viral replication by tannins and related compounds.	1992 May	1416904
The in vitro inhibitory effect of tannin derivatives on 3-hydroxy-3-methylglutaryl-coenzyme a reductase on vero cells.	2001 May	11359999
Isolation and structure elucidation of the major individual polyphenols in carob fibre.	2003 Dec	14563398
Antiviral compounds from traditional Chinese medicines Galla Chinese as inhibitors of HCV NS3 protease.	2004 Dec 20	15546725
Melanogenesis inhibition by gallotannins from Chinese galls in B16 mouse melanoma cells.	2009 Aug	19652388

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:57:45 GMT 2023` Edited by `admin` on `Sat Dec 16 09:57:45 GMT 2023`
Record UNII	4648S0G699
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NP-003686

Common Name

English

.BETA.-D-GLUCOPYRANOSE 1,2,3,6-TETRAGALLATE

Systematic Name

English

.BETA.-D-GLUCOPYRANOSE, 1,2,3,6-TETRAKIS(3,4,5-TRIHYDROXYBENZOATE)

Systematic Name

English

1,2,3,6-TETRA-O-GALLOYL-.BETA.-D-GLUCOSE

Systematic Name

English

1(.BETA.),2,3,6-TETRA-O-GALLOYLGLUCOSE

Systematic Name

English

1,2,3,6-TETRA-O-GALLOYL-.BETA.-D-GLUCOPYRANOSE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID80904234