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CHEBI:71000 - evomonoside

ChEBI IDCHEBI:71000
ChEBI Nameevomonoside
Stars
DefinitionA cardenolide glycoside consisting of digitoxigenin having an α-L-rhamnosyl moiety attached at the O3-position.
Last Modified17 December 2012
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC29H44O8
Net Charge0
Average Mass520.663
Monoisotopic Mass520.30362
SMILES[H][C@]12CC[C@]3([H])[C@]([H])(CC[C@@]4(C)[C@]3(O)CC[C@]4([H])C3=CC(=O)OC3)[C@@]1(C)CC[C@H](O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O)C2
InChIInChI=1S/C29H44O8/c1-15-23(31)24(32)25(33)26(36-15)37-18-6-9-27(2)17(13-18)4-5-21-20(27)7-10-28(3)19(8-11-29(21,28)34)16-12-22(30)35-14-16/h12,15,17-21,23-26,31-34H,4-11,13-14H2,1-3H3/t15-,17+,18-,19+,20-,21+,23-,24+,25+,26-,27-,28+,29-/m0/s1
InChIKeyWQMLFJWIKARBFW-BKKMTDGVSA-N
Roles Classification
Application:
cardioprotective agent  Any protective agent that is able to prevent damage to the heart.
ChEBI Ontology
Outgoing Relation(s)
evomonoside (CHEBI:71000) has functional parent digitoxigenin (CHEBI:42219)
evomonoside (CHEBI:71000) is a cardenolide glycoside (CHEBI:38092)
IUPAC Name 
3β-(6-deoxy-α-L-mannopyranosyloxy)-14-hydroxy-5β-card-20(22)-enolide
Synonyms  Source
Digitoxigenin rhamnosideChemIDplus
Digitoxigenin 3-rhamnosideChemIDplus
EvomonosidChemIDplus
3β-(α-L-rhamnopyranosyloxy)-14-hydroxy-5β-card-20(22)-enolideIUPAC
digitoxigenin α-L-rhamnosideChEBI
Registry NumbersSources
Reaxys:100629Reaxys
CAS:508-93-0ChemIDplus
Citations