input word = C00010668

Metabolite InformationStructural formula
Name 5-Deoxypulchelloside I
Formula C17H26O11
Mw 406.14751167
CAS RN
C_ID C00010668 ,
InChIKey QDEYKGKBMCIYCT-WCFTVPLTNA-N
InChICode InChI=1S/C17H26O11/c1-5-8-9(12(21)10(5)19)6(15(24)25-2)4-26-16(8)28-17-14(23)13(22)11(20)7(3-18)27-17/h4-5,7-14,16-23H,3H2,1-2H3/t5-,7+,8+,9+,10+,11+,12-,13+,14-,16-,17+/m0/s1
SMILES [C@H]12[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@@H]([C@H]([C@H]2O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVerbenaceaeCitharexylum fruticosum Ref.
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OrganismCitharexylum fruticosum
ReferenceMilz,Tetrahedron Lett.,(1978),895