input word = C00010774

Metabolite InformationStructural formula
Name Sylvestroside I
Formula C33H48O19
Mw 748.27897935
CAS RN 714361-22-6
C_ID C00010774 ,
InChIKey VSNATUGVSVGFFN-QGPDVHJONA-N
InChICode InChI=1S/C33H48O19/c1-4-13-14(5-6-34)16(10-46-30(13)51-32-26(41)24(39)22(37)19(8-35)49-32)29(44)48-18-7-15-17(28(43)45-3)11-47-31(21(15)12(18)2)52-33-27(42)25(40)23(38)20(9-36)50-33/h4,10-15,18-27,30-42H,1,5-9H2,2-3H3/t12-,13-,14-,15+,18-,19+,20-,21-,22+,23+,24-,25-,26-,27-,30-,31-,32-,33-/m0/s1
SMILES C=C[C@H]1[C@H](O[C@@H]2OC(CO)[C@@H](O)C(O)[C@@H]2O)OC=C(C(=O)O[C@H]2C[C@@H]3C(C(=O)OC)=CO[C@@H](O[C@@H]4OC(CO)[C@@H](O)C(O)[C@@H]4O)[C@@H]3[C@H]2C)[C@H]1CCO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDipsacaceae/Diervillaceae/Linnaeaceae/ValerianaceaeDipsacus sylvestris Ref.
PlantaeLonganiaceaeStrychnos lucida Ref.
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