CHEBI:228877 - Harpagide

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Harpagide
ChEBI ID CHEBI:228877
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H24O10
Net Charge 0
Average Mass 364.347
Monoisotopic Mass 364.13695
InChI InChI=1S/C15H24O10/c1-14(21)4-7(17)15(22)2-3-23-13(11(14)15)25-12-10(20)9(19)8(18)6(5-16)24-12/h2-3,6-13,16-22H,4-5H2,1H3/t6-,7-,8-,9+,10-,11?,12+,13+,14+,15-/m1/s1
InChIKey XUWSHXDEJOOIND-ZATIHQEFSA-N
SMILES O[C@@]12C([C@@](O)(C[C@H]1O)C)[C@H](O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)CO)OC=C2
Metabolite of Species Details
Zea mays (NCBI:txid4577) Found in exometabolome See: MetaboLights Study
ChEBI Ontology
Outgoing Harpagide (CHEBI:228877) is a glycoside (CHEBI:24400)
Harpagide (CHEBI:228877) is a iridoid monoterpenoid (CHEBI:50563)
IUPAC Name
(1S,4aS,5R,7S)-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-4a,5,7-triol
Manual Xref Database
8219858 ChemSpider
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