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CHEBI:139415 - 3-(4-hydroxyphenyl)-1-{2,4,6-trihydroxy-3,5-bis(2S,3R,4R,5S,6R)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl}propan-1-one

ChEBI IDCHEBI:139415
ChEBI Name3-(4-hydroxyphenyl)-1-{2,4,6-trihydroxy-3,5-bis(2S,3R,4R,5S,6R)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl}propan-1-one
Stars
ASCII Name3-(4-hydroxyphenyl)-1-{2,4,6-trihydroxy-3,5-bis(2S,3R,4R,5S,6R)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl}propan-1-one
Last Modified15 January 2018
Submittermwilliams
DownloadsMolfile
FormulaC27H34O15
Net Charge0
Average Mass598.554
Monoisotopic Mass598.18977
SMILES[H][C@@]1(c2c(O)c(C(=O)CCc3ccc(O)cc3)c(O)c([C@]3([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2O)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C27H34O15/c28-7-12-17(32)22(37)24(39)26(41-12)15-19(34)14(11(31)6-3-9-1-4-10(30)5-2-9)20(35)16(21(15)36)27-25(40)23(38)18(33)13(8-29)42-27/h1-2,4-5,12-13,17-18,22-30,32-40H,3,6-8H2/t12-,13-,17-,18-,22+,23+,24-,25-,26+,27+/m1/s1
InChIKeyWAWHTTXPRUWFCZ-DBGLWBBTSA-N
ChEBI Ontology
Outgoing Relation(s)
3-(4-hydroxyphenyl)-1-{2,4,6-trihydroxy-3,5-bis(2S,3R,4R,5S,6R)[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl}propan-1-one (CHEBI:139415) is a chalcones (CHEBI:23086)
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