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CHEBI:192502 - lambertianin C

Default Structure
ChEBI IDCHEBI:192502
ChEBI Namelambertianin C
Stars
DefinitionIs trimer of casuarictin linked by sanguisorbic acid ester groups between glucopyranose moieties. It contributes to the antioxidant capacity of raspberries.
SubmitterLiliana Andres Hernandez
DownloadsMolfile
FormulaC82H54O52
Net Charge0
Average Mass1871.282
Monoisotopic Mass1870.15811
SMILES[H]Oc1c([H])c(C(=O)O[C@]2([H])O[C@]3([H])C([H])([H])OC(=O)c4c([H])c(O[H])c(O[H])c(O[H])c4-c4c(O[H])c(O[H])c(O[H])c(Oc5c([H])c(C(=O)O[C@]6([H])O[C@]7([H])C([H])([H])OC(=O)c8c([H])c(O[H])c(O[H])c(O[H])c8-c8c(O[H])c(O[H])c(O[H])c([H])c8C(=O)O[C@@]7([H])[C@]7([H])OC(=O)c8c([H])c(O[H])c(O[H])c(O[H])c8-c8c(O[H])c(O[H])c(O[H])c([H])c8C(=O)O[C@@]67[H])c([H])c(O[H])c5O[H])c4C(=O)O[C@@]3([H])[C@]3([H])OC(=O)c4c([H])c(O[H])c(O[H])c(O[H])c4-c4c(O[H])c(O[H])c(O[H])c([H])c4C(=O)O[C@@]23[H])c([H])c(O[H])c1O[H]
InChIInChI=1S/C82H54O52/c83-23-1-14(2-24(84)45(23)93)71(112)133-81-70-68(130-77(118)20-9-30(90)50(98)57(105)39(20)41-22(79(120)132-70)11-32(92)52(100)59(41)107)65-35(126-81)13-123-74(115)17-6-27(87)53(101)60(108)42(17)43-44(80(121)128-65)66(63(111)62(110)61(43)109)124-33-4-15(3-25(85)46(33)94)72(113)134-82-69-67(129-76(117)19-8-29(89)49(97)56(104)38(19)40-21(78(119)131-69)10-31(91)51(99)58(40)106)64-34(125-82)12-122-73(114)16-5-26(86)47(95)54(102)36(16)37-18(75(116)127-64)7-28(88)48(96)55(37)103/h1-11,34-35,64-65,67-70,81-111H,12-13H2/t34-,35-,64-,65-,67+,68+,69-,70-,81+,82+/m1/s1
InChIKeyFFZOOOCGCNFHAQ-UTIVGCTBSA-N
Wikipedia
Roles Classification
Application:
astringent  A compound that causes the contraction of body tissues, typically used to reduce bleeding from minor abrasions.
ChEBI Ontology
Outgoing Relation(s)
lambertianin C (CHEBI:192502) is a ellagitannin (CHEBI:23909)
Manual XrefsDatabases
https://en.wikipedia.org/wiki/Lambertianin_CWikipedia