input word = C00009178

Metabolite InformationStructural formula
Name Robinetinidol-(4alpha->2')-dihydrorobinetin
Formula C30H24O13
Mw 592.12169086
CAS RN 161874-23-3
C_ID C00009178 ,
InChIKey ABQGXFBAMKSEEO-UMEKQKJGNA-N
InChICode InChI=1S/C30H24O13/c31-11-1-3-13-19(7-11)42-29(10-5-16(33)24(37)17(34)6-10)27(40)21(13)22-15(9-18(35)25(38)26(22)39)30-28(41)23(36)14-4-2-12(32)8-20(14)43-30/h1-9,21,27-35,37-41H/t21-,27-,28+,29+,30+/m0/s1
SMILES [C@@H]1([C@@H]([C@H](Oc2c1ccc(c2)O)c1cc(c(c(c1)O)O)O)O)c1c([C@@H]2[C@@H](C(=O)c3c(O2)cc(cc3)O)O)cc(c(c1O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeRobinia pseudoacacia Ref.
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