input word = C00014665

Metabolite InformationStructural formula
Name 6,4'-Dihydroxyaurone-4-O-neohesperidoside
Formula C27H30O14
Mw 578.16355567
CAS RN 571194-67-7
C_ID C00014665 ,
InChIKey BHJZUXDFACAILR-CQQWUBJSNA-N
InChICode InChI=1S/C27H30O14/c1-10-19(31)22(34)24(36)26(37-10)41-25-23(35)21(33)17(9-28)40-27(25)39-15-8-13(30)7-14-18(15)20(32)16(38-14)6-11-2-4-12(29)5-3-11/h2-8,10,17,19,21-31,33-36H,9H2,1H3/b16-6-/t10-,17+,19-,21+,22+,23-,24-,25-,26-,27+/m0/s1
SMILES c1(cc(c2c(c1)O/C(=C\c1ccc(cc1)O)/C2=O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePterocarpus santalinus Ref.
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OrganismPterocarpus santalinus
ReferenceSingh,J.Indian Chem.Soc.,80,(2003),190