input word = C00006035

Metabolite InformationStructural formula
Name Haploside D
Formula C30H34O18
Mw 682.17451429
CAS RN 79852-10-1
C_ID C00006035 ,
InChIKey LLPAOCBYQCXXKS-FXKZFZHFNA-N
InChICode InChI=1S/C30H34O18/c1-9-18(34)22(38)25(41)29(44-9)48-28-23(39)19(35)16(8-43-10(2)31)46-30(28)45-15-7-13(33)17-21(37)24(40)26(47-27(17)20(15)36)11-4-5-12(32)14(6-11)42-3/h4-7,9,16,18-19,22-23,25,28-30,32-36,38-41H,8H2,1-3H3/t9-,16-,18+,19-,22?,23+,25-,28+,29+,30-/m1/s1
SMILES COc1cc(-c2oc3c(O)c(O[C@@H]4OC(COC(C)=O)[C@@H](O)[C@H](O)C4O[C@@H]4OC(C)[C@H](O)[C@H](O)C4O)cc(O)c3c(=O)c2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeHaplophyllum dauricum Ref.
PlantaeRutaceaeHaplophyllum perforatum Ref.
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