input word = C00048993

Metabolite InformationStructural formula
Name Gonocaryoside B
Formula C21H30O14
Mw 506.16355567
CAS RN 165198-90-3
C_ID C00048993 ,
InChIKey FNFFIQZXXUOMTL-HDPLIBJFNA-N
InChICode InChI=1S/C21H30O14/c1-7-13-9(4-12(23)33-8(2)21(3,30)20(29)32-7)10(17(27)28)6-31-18(13)35-19-16(26)15(25)14(24)11(5-22)34-19/h6-9,11,13-16,18-19,22,24-26,30H,4-5H2,1-3H3,(H,27,28)/t7-,8-,9+,11+,13+,14+,15-,16+,18-,19-,21-/m0/s1
SMILES C[C@@H]1OC(=O)[C@@](C)(O)[C@H](C)OC(=O)C[C@@H]2C(C(=O)O)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIcacinaceaeGonocaryum calleryanum Ref.
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