input word = C00064115

Metabolite InformationStructural formula
Name Alatanin G
Formula C37H39O19
Mw 787.20855407
CAS RN 1978410-77-3
C_ID C00064115
InChIKey XGESDWPUQUOOMT-OTOOEMNYSA-O
InChICode InChI=1S/C37H38O19/c1-50-24-8-15(2-5-20(24)40)3-7-28(43)51-13-26-29(44)31(46)33(48)36(55-26)52-14-27-30(45)32(47)34(49)37(56-27)54-25-12-18-21(41)10-17(38)11-23(18)53-35(25)16-4-6-19(39)22(42)9-16/h2-12,26-27,29-34,36-37,44-49H,13-14H2,1H3,(H4-,38,39,40,41,42,43)/p+1/t26-,27-,29-,30-,31+,32+,33-,34-,36-,37-/m1/s1
SMILES COc1cc(C=CC(=O)OCC2OC(OCC3OC(Oc4cc5c(O)cc(O)cc5[o+]c4-c4ccc(O)c(O)c4)C(O)C(O)C3O)C(O)C(O)C2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDioscoreaceaeDioscorea alata Ref.
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