CHEBI:176167 - ax-4''-Hydroxy-3-'-methoxymaysin

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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 ax-4''-Hydroxy-3-'-methoxymaysin
ChEBI ID CHEBI:176167
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C28H32O14
Net Charge 0
Average Mass 592.550
Monoisotopic Mass 592.17921
InChI InChI=1S/C28H32O14/c1-9-21(33)24(36)27(42-28-25(37)23(35)20(32)10(2)40-28)26(39-9)19-14(31)8-17-18(22(19)34)13(30)7-15(41-17)11-4-5-12(29)16(6-11)38-3/h4-10,20-21,23-29,31-37H,1-3H3
InChIKey KLULJHGQHYLYGV-UHFFFAOYSA-N
SMILES O(C1C(O)C(O)C(OC1C2=C(O)C3=C(OC(=CC3=O)C4=CC(OC)=C(O)C=C4)C=C2O)C)C5OC(C(O)C(O)C5O)C
ChEBI Ontology
Outgoing ax-4''-Hydroxy-3-'-methoxymaysin (CHEBI:176167) is a C-glycosyl compound (CHEBI:20857)
ax-4''-Hydroxy-3-'-methoxymaysin (CHEBI:176167) is a flavonoids (CHEBI:72544)
IUPAC Name
6-[4,5-dihydroxy-6-methyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one
Manual Xref Database
HMDB0030238 HMDB
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