CHEBI:196280 - ent-Robinetinidol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 ent-Robinetinidol
ChEBI ID CHEBI:196280
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H14O6
Net Charge 0
Average Mass 290.271
Monoisotopic Mass 290.07904
InChI InChI=1S/C15H14O6/c16-9-2-1-7-3-12(19)15(21-13(7)6-9)8-4-10(17)14(20)11(18)5-8/h1-2,4-6,12,15-20H,3H2/t12-,15+/m1/s1
InChIKey GMPPKSLKMRADRM-DOMZBBRYSA-N
SMILES O1[C@H]([C@H](O)CC2=C1C=C(O)C=C2)C3=CC(O)=C(O)C(O)=C3
ChEBI Ontology
Outgoing ent-Robinetinidol (CHEBI:196280) is a hydroxyflavan (CHEBI:72010)
IUPAC Name
5-[(2S,3R)-3,7-dihydroxy-3,4-dihydro-2H-chromen-2-yl]benzene-1,2,3-triol
Manual Xrefs Databases
24842501 ChemSpider
LMPK12020018 LIPID MAPS
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