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Details

Stereochemistry ABSOLUTE
Molecular Formula C58H86O13
Molecular Weight 991.2956
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EPIGALLOCATECHIN GALLATE 4,4'-DISTEARATE

SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1=C(O)C=C(C=C1O)[C@H]2OC3=C(C[C@H]2OC(=O)C4=CC(O)=C(OC(=O)CCCCCCCCCCCCCCCCC)C(O)=C4)C(O)=CC(O)=C3

InChI

InChIKey=CRKIQQBZRVDCOM-MSDPODROSA-N
InChI=1S/C58H86O13/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-53(65)70-56-47(61)35-42(36-48(56)62)55-52(41-45-46(60)39-44(59)40-51(45)68-55)69-58(67)43-37-49(63)57(50(64)38-43)71-54(66)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-40,52,55,59-64H,3-34,41H2,1-2H3/t52-,55-/m1/s1

HIDE SMILES / InChI

Molecular Formula C58H86O13
Molecular Weight 991.2956
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 09:58:02 GMT 2023
Edited
by admin
on Sat Dec 16 09:58:02 GMT 2023
Record UNII
94T60Q9FD3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EPIGALLOCATECHIN GALLATE 4,4'-DISTEARATE
Common Name English
EGCG 4,4'-DISTEARATE
Common Name English
Code System Code Type Description
PUBCHEM
76962005
Created by admin on Sat Dec 16 09:58:02 GMT 2023 , Edited by admin on Sat Dec 16 09:58:02 GMT 2023
PRIMARY
FDA UNII
94T60Q9FD3
Created by admin on Sat Dec 16 09:58:02 GMT 2023 , Edited by admin on Sat Dec 16 09:58:02 GMT 2023
PRIMARY