CHEBI:197019 - Echioidinin 2'-(6''-acetylglucoside)

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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 Echioidinin 2'-(6''-acetylglucoside)
ChEBI ID CHEBI:197019
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H24O11
Net Charge 0
Average Mass 488.445
Monoisotopic Mass 488.13186
InChI InChI=1S/C24H24O11/c1-11(25)32-10-19-21(28)22(29)23(30)24(35-19)34-16-6-4-3-5-13(16)17-9-15(27)20-14(26)7-12(31-2)8-18(20)33-17/h3-9,19,21-24,26,28-30H,10H2,1-2H3/t19?,21-,22+,23?,24-/m1/s1
InChIKey NYESETAMVRXBOD-HSQINTTRSA-N
SMILES O1C([C@@H](O)[C@H](O)C(O)[C@@H]1OC=2C(C=3OC=4C(C(=O)C3)=C(O)C=C(OC)C4)=CC=CC2)COC(=O)C
Metabolite of Species Details
Cannabis sativa (NCBI:txid3483) Found in inflorescence (BTO:0000628). of strain Cannabis sativa var. DMG265 See: MetaboLights Study
ChEBI Ontology
Outgoing Echioidinin 2'-(6''-acetylglucoside) (CHEBI:197019) is a ether (CHEBI:25698)
Echioidinin 2'-(6''-acetylglucoside) (CHEBI:197019) is a flavonoids (CHEBI:72544)
IUPAC Name
[(3S,4S,6S)-3,4,5-trihydroxy-6-[2-(5-hydroxy-7-methoxy-4-oxochromen-2-yl)phenoxy]oxan-2-yl]methyl acetate
Manual Xrefs Databases
24843207 ChemSpider
LMPK12110121 LIPID MAPS
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