EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:11412 - (2R,3S,4S)-leucocyanidin

ChEBI IDCHEBI:11412
ChEBI Name(2R,3S,4S)-leucocyanidin
Stars
ASCII Name(2R,3S,4S)-leucocyanidin
Last Modified15 August 2017
DownloadsMolfile
FormulaC15H14O7
Net Charge0
Average Mass306.270
Monoisotopic Mass306.07395
SMILESOc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@@H](O)[C@H]2O
InChIInChI=1S/C15H14O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,13-21H/t13-,14-,15+/m0/s1
InChIKeySBZWTSHAFILOTE-SOUVJXGZSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3S,4S)-leucocyanidin (CHEBI:11412) is a (2R,3S,4S)-leucoanthocyanidin (CHEBI:138176)
(2R,3S,4S)-leucocyanidin (CHEBI:11412) is a leucocyanidin (CHEBI:15758)
Incoming Relation(s)
3-deoxyleucocyanidin (CHEBI:27686) has functional parent (2R,3S,4S)-leucocyanidin (CHEBI:11412)
IUPAC Name 
(2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,4,5,7-tetrol
Synonyms  Source
2r-(3,4-dihydroxyphenyl)chromane-3t,4t,5,7-tetrolChEBI
2,3-trans-3,4-cis-LeucocyanidinKEGG COMPOUND
LeucocyanidolKEGG COMPOUND
ResivitKEGG COMPOUND
2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,4,5,7-tetrolKEGG COMPOUND
3,4-CyanidiolKEGG COMPOUND
UniProt Name  Source
(2R,3S,4S)-leucocyanidinUniProt
Manual XrefsDatabases
C05906KEGG COMPOUND
D08112KEGG DRUG
C00007235KNApSAcK
C00008991KNApSAcK
Registry NumbersSources
Beilstein:6574536Beilstein
CAS:93527-39-0KEGG COMPOUND