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Substance Name: Epigallocatechin gallate 4'-palmitate
RN: 507453-56-7
UNII: 3H4430NO4A
InChIKey: VCWNMZDXDWVOJD-YYFXGUOYSA-N

Molecular Formula

  • C38-H48-O12

Molecular Weight

  • 696.7852
 
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Names and Synonyms

Name of Substance

  • Epigallocatechin gallate 4'-palmitate

Synonyms

  • Benzoic acid, 3,4,5-trihydroxy-, (2R,3R)-2-(3,5-dihydroxy-4-((1-oxohexadecyl)oxy)phenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester
  • Egcg 4'-palmitate
  • Epigallocatechin gallate 4'-palmitate
  • UNII-3H4430NO4A

Registry Numbers

CAS Registry Number

  • 507453-56-7

FDA UNII

  • 3H4430NO4A

System Generated Number

  • 0507453567

Structure Descriptors

InChI

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

InChIKey

VCWNMZDXDWVOJD-YYFXGUOYSA-N

Smiles

CCCCCCCCCCCCCCCC(=O)Oc1c(cc(cc1O)[C@@H]2[C@@H](Cc3c(cc(cc3O2)O)O)OC(=O)c4cc(c(c(c4)O)O)O)O