CHEBI:179870 - Hovetrichoside C

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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 Hovetrichoside C
ChEBI ID CHEBI:179870
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C21H22O11
Net Charge 0
Average Mass 450.396
Monoisotopic Mass 450.11621
InChI InChI=1S/C21H22O11/c22-8-14-16(25)17(26)18(27)20(31-14)30-12-5-11(24)6-13-15(12)19(28)21(29,32-13)7-9-1-3-10(23)4-2-9/h1-6,14,16-18,20,22-27,29H,7-8H2/t14?,16-,17+,18?,20-,21?/m1/s1
InChIKey KJIWCKSQHHNTTL-RDBLRTHZSA-N
SMILES O1C([C@@H](O)[C@H](O)C(O)[C@@H]1OC=2C=3C(=O)C(OC3C=C(O)C2)(O)CC4=CC=C(O)C=C4)CO
ChEBI Ontology
Outgoing Hovetrichoside C (CHEBI:179870) is a aurones (CHEBI:72576)
Hovetrichoside C (CHEBI:179870) is a glycoside (CHEBI:24400)
IUPAC Name
2,6-dihydroxy-2-[(4-hydroxyphenyl)methyl]-4-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzouran-3-one
Manual Xrefs Databases
24846206 ChemSpider
LMPK12130069 LIPID MAPS
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