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CHEBI:192501 - sanguiin H6

ChEBI IDCHEBI:192501
ChEBI Namesanguiin H6
Stars
DefinitionDimer of casuarictin linked by a bond between the gallic acid residue and one of the hexahydroxydiphenic acid units. It has sanguisorbic acid ester groups as linking units between glucopyranose moieties.
SubmitterLiliana Andres Hernandez
DownloadsMolfile
FormulaC82H54O52
Net Charge0
Average Mass1871.282
Monoisotopic Mass1870.15811
SMILES[H]Oc1c([H])c(C(=O)OC2([H])OC3([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)OC6([H])OC7([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)OC7([H])C7([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)OC67[H])c([H])c(O[H])c5O[H])c4C(=O)OC3([H])C3([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)OC23[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
InChIKeyFFZOOOCGCNFHAQ-UHFFFAOYSA-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)
sanguiin H6 (CHEBI:192501) is a ellagitannin (CHEBI:23909)
Manual XrefsDatabases
https://en.wikipedia.org/wiki/Sanguiin_H-6Wikipedia