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 COc1cc(Cc2c(O)cc(O)c3c(=O)c(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(-c4ccc(O)c(O)c4)oc23)cc(OC)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrchidaceaeGoodyera schlechtendaliana Ref.
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