CHEBI:27686 - 3-deoxyleucocyanidin

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 3-deoxyleucocyanidin ChEBI ID CHEBI:27686 Definition A leucoanthocyanidin that is the 3-deoxy derivative of (2R,3S,4S)-leucocyanidin. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:20010, CHEBI:1497 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C15H14O6 Net Charge 0 Average Mass 290.26810 Monoisotopic Mass 290.07904 InChI InChI=1S/C15H14O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,12-13,16-20H,6H2/t12?,13-/m0/s1 InChIKey FSYDWKPCKNCRDI-ABLWVSNPSA-N SMILES OC1C[C@H](Oc2cc(O)cc(O)c12)c1ccc(O)c(O)c1 ChEBI Ontology Outgoing 3-deoxyleucocyanidin (CHEBI:27686) has functional parent (2R,3S,4S)-leucocyanidin (CHEBI:11412) 3-deoxyleucocyanidin (CHEBI:27686) is a leucoanthocyanidin (CHEBI:60835) 3-deoxyleucocyanidin (CHEBI:27686) is a pentahydroxyflavan (CHEBI:72584) IUPAC Name (2S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-4,5,7-triol Synonyms Sources (2S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4,5,7-triol ChEBI (2S)-luteoforol ChEBI 3-Deoxyleucocyanidin KEGG COMPOUND 3-Deoxyleucocyanidin KEGG COMPOUND Luteoforol KEGG COMPOUND Manual Xrefs Databases 3-Deoxyleucocyanidin Wikipedia C00008977 KNApSAcK C05907 KEGG COMPOUND HMDB0041310 HMDB View more database links Registry Numbers Types Sources 24897-98-1 CAS Registry Number KEGG COMPOUND 24897-98-1 CAS Registry Number ChemIDplus 6738837 Reaxys Registry Number Reaxys Citation Type Source 16806954 PubMed citation Europe PMC Last Modified 28 July 2014