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CHEBI:140125 - Caohuoside D

ChEBI IDCHEBI:140125
ChEBI NameCaohuoside D
Stars
Last Modified13 February 2018
Submittermwilliams
DownloadsMolfile
FormulaC28H34O12
Net Charge0
Average Mass562.568
Monoisotopic Mass562.20503
SMILESCOc1ccc(-c2oc3c(CCC(C)(C)OC)c(O[C@@H]4OC(CO)[C@@H](O)C(O)[C@@H]4O)cc(O)c3c(=O)c2O)cc1
InChIInChI=1S/C28H34O12/c1-28(2,37-4)10-9-15-17(38-27-24(35)22(33)20(31)18(12-29)39-27)11-16(30)19-21(32)23(34)25(40-26(15)19)13-5-7-14(36-3)8-6-13/h5-8,11,18,20,22,24,27,29-31,33-35H,9-10,12H2,1-4H3/t18?,20-,22?,24+,27-/m1/s1
InChIKeyIINPFAXRBBMPBJ-MHBDZQQBSA-N
ChEBI Ontology
Outgoing Relation(s)
Caohuoside D (CHEBI:140125) is a flavonoids (CHEBI:72544)
Caohuoside D (CHEBI:140125) is a glycoside (CHEBI:24400)
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