CHEBI:141141 - 8,8"-methylene-bisquercetin

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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 8,8"-methylene-bisquercetin
ChEBI ID CHEBI:141141
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C31H20O14
Net Charge 0
Average Mass 616.483
Monoisotopic Mass 616.08531
InChI InChI=1S/C31H20O14/c32-14-3-1-10(5-18(14)36)28-26(42)24(40)22-20(38)8-16(34)12(30(22)44-28)7-13-17(35)9-21(39)23-25(41)27(43)29(45-31(13)23)11-2-4-15(33)19(37)6-11/h1-6,8-9,32-39,42-43H,7H2
InChIKey SNZFLLTWYNOOLR-UHFFFAOYSA-N
SMILES C12=C(C(=CC(=C2C(C(=C(O1)C=3C=CC(=C(C3)O)O)O)=O)O)O)CC=4C5=C(C(=CC4O)O)C(C(=C(O5)C=6C=CC(=C(C6)O)O)O)=O
ChEBI Ontology
Outgoing 8,8"-methylene-bisquercetin (CHEBI:141141) has functional parent quercetin (CHEBI:16243)
8,8"-methylene-bisquercetin (CHEBI:141141) is a 7-hydroxyflavonol (CHEBI:52267)
Last Modified
25 June 2018