EPIGALLOCATECHIN GALLATE 3'-PALMITATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C38H48O12
Molecular Weight	696.7805
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of EPIGALLOCATECHIN GALLATE 3'-PALMITATE

Structure Search

SMILES

CCCCCCCCCCCCCCCC(=O)OC1=C(O)C(O)=CC(=C1)[C@H]2OC3=C(C[C@H]2OC(=O)C4=CC(O)=C(O)C(O)=C4)C(O)=CC(O)=C3

InChI

InChIKey=KXCIOTCUJXIMFD-PZSMLTKBSA-N

InChI=1S/C38H48O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-34(44)48-32-19-23(16-30(43)36(32)46)37-33(22-26-27(40)20-25(39)21-31(26)49-37)50-38(47)24-17-28(41)35(45)29(42)18-24/h16-21,33,37,39-43,45-46H,2-15,22H2,1H3/t33-,37-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C38H48O12
Molecular Weight	696.7805
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 `Sat Dec 16 08:47:02 GMT 2023` Edited by `admin` on `Sat Dec 16 08:47:02 GMT 2023`
Record UNII	DV2KMY27M9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

EPIGALLOCATECHIN GALLATE 3'-PALMITATE

Common Name

English

EGCG 3'-PALMITATE

Common Name

English

BENZOIC ACID, 3,4,5-TRIHYDROXY-, (2R,3R)-2-(3,4-DIHYDROXY-5-((1-OXOHEXADECYL)OXY)PHENYL)-3,4-DIHYDRO-5,7-DIHYDROXY-2H-1-BENZOPYRAN-3-YL ESTER

Systematic Name

English

Code System Code Type Description

CAS

948837-65-8

Created by admin on Sat Dec 16 08:47:02 GMT 2023 , Edited by admin on Sat Dec 16 08:47:02 GMT 2023

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PUBCHEM

16739240

Created by admin on Sat Dec 16 08:47:02 GMT 2023 , Edited by admin on Sat Dec 16 08:47:02 GMT 2023

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FDA UNII

DV2KMY27M9

Created by admin on Sat Dec 16 08:47:02 GMT 2023 , Edited by admin on Sat Dec 16 08:47:02 GMT 2023

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