input word = C00037212

Metabolite InformationStructural formula
Name Goodyerin
(+)-Goodyerin
Formula C36H40O19
Mw 776.2163791
CAS RN 280570-09-4
C_ID C00037212 ,
InChIKey WODANCDMGTVKAL-WOOQHWMSNA-N
InChICode InChI=1S/C36H40O19/c1-12-24(41)28(45)30(47)35(52-12)51-11-22-26(43)29(46)31(48)36(53-22)55-34-27(44)23-19(40)10-17(38)15(6-13-7-20(49-2)25(42)21(8-13)50-3)33(23)54-32(34)14-4-5-16(37)18(39)9-14/h4-5,7-10,12,22,24,26,28-31,35-43,45-48H,6,11H2,1-3H3/t12-,22+,24-,26+,28+,29-,30+,31+,35+,36-/m0/s1
SMILES c1(cc(c2c(c1Cc1cc(c(c(c1)OC)O)OC)oc(c(c2=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)O)O)c1ccc(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrchidaceaeGoodyera schlechtendaliana Ref.
zoom in