input word = C00010764

Metabolite InformationStructural formula
Name Jasmesoside
Formula C27H42O13
Mw 574.26254143
CAS RN 97777-70-3
C_ID C00010764 ,
InChIKey XUGQSOFCBOWZDO-YOKHGFDQNA-N
InChICode InChI=1S/C27H42O13/c1-5-14-16(7-21(31)37-10-17-13(3)19(30)6-15(17)12(2)8-28)18(25(35)36-4)11-38-26(14)40-27-24(34)23(33)22(32)20(9-29)39-27/h5,11-17,19-20,22-24,26-30,32-34H,1,6-10H2,2-4H3/t12-,13-,14-,15+,16-,17-,19-,20-,22+,23+,24+,26-,27+/m1/s1
SMILES C1[C@H]([C@@H]([C@H]([C@@H]1O)C)COC(=O)C[C@@H]1[C@H]([C@H](OC=C1C(=O)OC)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@@H]1O)O)O)CO)C=C)[C@H](C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeJasminum mesnyi Ref.
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