U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

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=CC(=CC(O)=C1O)C(=O)O[C@@H]2CC3=C(O[C@@H]2C4=CC(O)=C(O)C(O)=C4)C=C(O)C=C3O

InChI

InChIKey=LUGXPIAYYJFLBB-PZSMLTKBSA-N
InChI=1S/C38H48O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-34(44)48-32-19-24(18-30(43)36(32)46)38(47)50-33-22-26-27(40)20-25(39)21-31(26)49-37(33)23-16-28(41)35(45)29(42)17-23/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
BENZOIC ACID, 3,4-DIHYDROXY-5-((1-OXOHEXADECYL)OXY)-, (2R,3R)-3,4-DIHYDRO-5,7-DIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-2H-1-BENZOPYRAN-3-YL ESTER
Systematic Name English
EGCG 3-PALMITATE
Common Name English
Code System Code Type Description
PUBCHEM
44195667
Created by admin on Sat Dec 16 08:45:39 GMT 2023 , Edited by admin on Sat Dec 16 08:45:39 GMT 2023
PRIMARY
CAS
948837-66-9
Created by admin on Sat Dec 16 08:45:39 GMT 2023 , Edited by admin on Sat Dec 16 08:45:39 GMT 2023
PRIMARY
FDA UNII
0A729294LS
Created by admin on Sat Dec 16 08:45:39 GMT 2023 , Edited by admin on Sat Dec 16 08:45:39 GMT 2023
PRIMARY