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CHEBI:9433 - Tellimagrandin I

ChEBI IDCHEBI:9433
ChEBI NameTellimagrandin I
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC34H26O22
Net Charge0
Average Mass786.560
Monoisotopic Mass786.09157
SMILESO=C(O[C@H]1[C@@H]2OC(=O)c3cc(O)c(O)c(O)c3-c3c(cc(O)c(O)c3O)C(=O)OC[C@H]2OC(O)[C@@H]1OC(=O)c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1
InChIInChI=1S/C34H26O22/c35-12-1-8(2-13(36)21(12)41)30(47)55-28-27-18(53-34(51)29(28)56-31(48)9-3-14(37)22(42)15(38)4-9)7-52-32(49)10-5-16(39)23(43)25(45)19(10)20-11(33(50)54-27)6-17(40)24(44)26(20)46/h1-6,18,27-29,34-46,51H,7H2/t18-,27-,28+,29-,34?/m1/s1
InChIKeyYKDNTEQLKGYZHT-HTCCRONFSA-N
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)
Tellimagrandin I (CHEBI:9433) is a tannin (CHEBI:26848)
Synonyms  Source
Tellimagrandin IKEGG COMPOUND
1-DesgalloyleugeniinKEGG COMPOUND
Manual XrefsDatabases
C10241KEGG COMPOUND
C00002938KNApSAcK
Registry NumbersSources
CAS:79786-08-6KEGG COMPOUND