EPIGALLOCATECHIN GALLATE 3'-STEARATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H52O12
Molecular Weight	724.8337
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of EPIGALLOCATECHIN GALLATE 3'-STEARATE

Structure Search

SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1=CC(=CC(O)=C1O)[C@H]2OC3=CC(O)=CC(O)=C3C[C@H]2OC(=O)C4=CC(O)=C(O)C(O)=C4

InChI

InChIKey=ZYJAWGWNUGXBEE-JGBHCADMSA-N

InChI=1S/C40H52O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-36(46)50-34-21-25(18-32(45)38(34)48)39-35(24-28-29(42)22-27(41)23-33(28)51-39)52-40(49)26-19-30(43)37(47)31(44)20-26/h18-23,35,39,41-45,47-48H,2-17,24H2,1H3/t35-,39-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C40H52O12
Molecular Weight	724.8337
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:17:46 GMT 2025` Edited by `admin` on `Mon Mar 31 22:17:46 GMT 2025`
Record UNII	RI3I10D109
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

EPIGALLOCATECHIN GALLATE 3'-STEARATE

Common Name

English

EGCG 3'-STEARATE

Preferred Name

English

(2R,3R)-2-(3,4-DIHYDROXY-5-(STEAROYLOXY)PHENYL)-5,7-DIHYDROXYCHROMAN-3-YL 3,4,5-TRIHYDROXYBENZOATE

Systematic Name

English

Code System Code Type Description

FDA UNII

RI3I10D109

Created by admin on Mon Mar 31 22:17:46 GMT 2025 , Edited by admin on Mon Mar 31 22:17:46 GMT 2025

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PUBCHEM

76961109

Created by admin on Mon Mar 31 22:17:46 GMT 2025 , Edited by admin on Mon Mar 31 22:17:46 GMT 2025

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