input word = C00048992

Metabolite InformationStructural formula
Name Gonocaryoside A
Formula C22H32O14
Mw 520.17920573
CAS RN 165198-89-0
C_ID C00048992 ,
InChIKey DXAZCDQDCNQCTJ-DTIQJEPPNA-N
InChICode InChI=1S/C22H32O14/c1-8-14-10(5-13(24)34-9(2)22(3,30)21(29)33-8)11(18(28)31-4)7-32-19(14)36-20-17(27)16(26)15(25)12(6-23)35-20/h7-10,12,14-17,19-20,23,25-27,30H,5-6H2,1-4H3/t8-,9-,10+,12+,14+,15+,16-,17+,19-,20-,22-/m0/s1
SMILES O1C=C([C@@H]2[C@H]([C@@H]1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)[C@@H](OC(=O)[C@@]([C@@H](OC(=O)C2)C)(C)O)C)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIcacinaceaeGonocaryum calleryanum Ref.
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OrganismGonocaryum calleryanum
ReferenceChan,Phytochem.,47,(1998),1073