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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

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

Approval Year

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
PRIMARY
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
PRIMARY
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
PRIMARY