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Kaempferol 3-o-rutinoside

C27H30O15 594.5 g/mol
O O O O O O H H O O O H O H O H H O O H O H H O
Name Kaempferol 3-o-rutinoside
Alternative name Nicotiflorin
Formula C27H30O15
Formula Weight 594.50 g/mol
Molecular Weight 594.50 g/mol
Monoisotopic Mass 594.158000 g/mol
InChI Key RTATXGUCZHCSNG-QHWHWDPRSA-N
IUPAC 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
InChI InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3
SMILES CC1OC(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)C(O)C(O)C2O)C(O)C(O)C1O
Food Berry, 
Food Source Cranberry, 
Family Phenolic
Class Flavonoid
Subclass Group Flavonol derivative
Subclass Flavonol
Metabolite Flavonol metabolite
CASNO 17650-84-9
HMDB HMDB0037574
PubChem 5318767
KEGG C12249
FooDB FDB016666
DrugBank DB01852
ChEBI 139410
BioCyc CPD1F-453
METLIN 3445.0