input word = C00005724

Metabolite InformationStructural formula
Name Chrysosplenoside E
Formula C25H28O13
Mw 536.15299098
CAS RN 27625-90-7
C_ID C00005724 ,
InChIKey CWMJIRNVYCGZQQ-XEUOBEQJNA-N
InChICode InChI=1S/C25H28O13/c1-32-10-5-12(27)18-16(6-10)36-23(24(35-4)20(18)29)11-7-14(33-2)15(34-3)8-13(11)37-25-22(31)21(30)19(28)17(9-26)38-25/h5-8,17,19,21-22,25-28,30-31H,9H2,1-4H3/t17-,19-,21+,22+,25-/m1/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)OC)c1cc(c(cc1O[C@H]1[C@H]([C@H]([C@H](O)[C@H](O1)CO)O)O)OC)OC)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSaxifragaceaeChrysosplenium americanum Ref.
PlantaeSaxifragaceaeChrysosplenium grayanum Ref.
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