input word = C00004456

Metabolite InformationStructural formula
Name Tricetin 3',5'-diglucoside
Formula C27H30O17
Mw 626.14829954
CAS RN 93373-19-4
C_ID C00004456 ,
InChIKey FGXPFHJCXGTOKL-WXHBCBBSNA-N
InChICode InChI=1S/C27H30O17/c28-6-16-20(34)22(36)24(38)26(43-16)41-14-1-8(12-5-11(32)18-10(31)3-9(30)4-13(18)40-12)2-15(19(14)33)42-27-25(39)23(37)21(35)17(7-29)44-27/h1-5,16-17,20-31,33-39H,6-7H2/t16-,17-,20-,21-,22-,23+,24-,25-,26-,27-/m1/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1cc(c(c(c1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePodocarpaceaeDacrycarpus dacrydioides Ref.
zoom in