input word = C00050129

Metabolite InformationStructural formula
Name Jaslanceoside E
(-)-Jaslanceoside E
Formula C26H30O15
Mw 582.15847029
CAS RN 188796-00-1
C_ID C00050129 ,
InChIKey ITYIBAWOOIUABX-GYEVZIJRNA-N
InChICode InChI=1S/C26H30O15/c1-37-20(31)9-14-13(6-7-38-19(30)5-3-12-2-4-16(28)17(29)8-12)25(39-11-15(14)24(35)36)41-26-23(34)22(33)21(32)18(10-27)40-26/h2-6,8,11,14,18,21-23,25-29,32-34H,7,9-10H2,1H3,(H,35,36)/b5-3+,13-6+/t14-,18+,21+,22-,23+,25-,26-/m0/s1
SMILES C1=C([C@H](/C(=C\COC(=O)/C=C/c2ccc(c(c2)O)O)/[C@@H](O1)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)CC(=O)OC)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeJasminum lanceolarium Ref.
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OrganismJasminum lanceolarium
ReferenceShen,J.Nat.Prod.,60,(1997),453